| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 46.1 | Very low | 52.2 | Low | 242 Ų | 242 | 164 Ų | 164 | 100% | 1.192 | 86% | 0.861 | S | S | * | * | 0 | 114 | 0 | -140 | 157.9 | 167.8 | 0 | 0 | 106.9 | |||||
| 2 | N | 47.2 | Very low | 51.8 | Low | 164 Ų | 164 | 159.5 Ų | 159.5 | 88% | 0.877 | 85% | 0.854 | S | S | * | * | trans | 54.2 | 105 | 171.3 | -65.2 | -1.3 | 0 | 0 | 0 | 121.6 | ||||
| 3 | M | 44.2 | Very low | 52.2 | Low | 172 Ų | 172 | 156.4 Ų | 156.4 | 85% | 0.847 | 85% | 0.847 | S | S | * | * | trans | -81.9 | 167.2 | 156.4 | -68.8 | -177.8 | 163 | 0 | 0 | 111.6 | ||||
| 4 | N | 52.8 | Low | 51.7 | Low | 140 Ų | 140 | 152.2 Ų | 152.2 | 75% | 0.749 | 84% | 0.836 | S | S | * | * | trans | 100.5 | 105.2 | 156.4 | -56.6 | -20.1 | 0 | 0 | 0 | 116.1 | ||||
| 5 | D | 55.4 | Low | 51.5 | Low | 155 Ų | 155 | 155.4 Ų | 155.4 | 83% | 0.829 | 84% | 0.842 | S | S | * | * | -173.8 | 95.5 | 121 | -84.9 | -23.5 | 0 | 0 | 0 | 109.2 | |||||
| 6 | C | 60.7 | Low | 51.6 | Low | 136 Ų | 136 | 153.3 Ų | 153.3 | 92% | 0.919 | 84% | 0.836 | S | S | * | * | trans | -96.8 | 100.3 | 172.8 | -124 | 0 | 0 | 0 | 0 | 108.8 | T8 | C6-T8 PolarHBondContact O-N 3.46Š| ||
| 7 | Q | 59.1 | Low | 51.1 | Low | 179 Ų | 179 | 151.4 Ų | 151.4 | 84% | 0.836 | 84% | 0.837 | S | S | * | * | trans | -72.5 | 121.8 | 172.7 | -66.7 | -179.4 | 19.9 | 0 | 0 | 110.1 | T9 | Q7-T9 PolarHBondContact O-N 3.28Š| ||
| 8 | T | 55.6 | Low | 51.4 | Low | 132 Ų | 132 | 150.3 Ų | 150.3 | 81% | 0.81 | 84% | 0.835 | S | S | * | * | trans | -70.7 | 104 | 173.3 | -55.5 | 0 | 0 | 0 | 0 | 109.9 | C6 M10 | C6-T8 PolarHBondContact O-N 3.46Å; T8-M10 PolarHBondContact O-N 2.73Å | ||
| 9 | T | 56.3 | Low | 51.4 | Low | 110 Ų | 110 | 151.1 Ų | 151.1 | 68% | 0.675 | 83% | 0.832 | S | S | * | * | trans | -70.4 | 114.9 | 169.5 | 44.5 | 0 | 0 | 0 | 0 | 110.5 | Q7 F11 | Q7-T9 PolarHBondContact O-N 3.28Å; T9-F11 PolarHBondContact O-N 2.89Å | ||
| 10 | M | 45.8 | Very low | 51.1 | Low | 183 Ų | 183 | 151.4 Ų | 151.4 | 90% | 0.901 | 83% | 0.832 | S | S | * | * | trans | -63.2 | 109.9 | 172.6 | -69.4 | -85.4 | -80.2 | 0 | 0 | 110.6 | T8 | T8-M10 PolarHBondContact O-N 2.73Š| ||
| 11 | F | 51.4 | Low | 51.1 | Low | 191 Ų | 191 | 148.9 Ų | 148.9 | 84% | 0.838 | 82% | 0.821 | S | S | * | * | trans | -85.5 | 114.1 | 165.9 | -89.8 | -85 | 0 | 0 | 0 | 109.8 | T9 | T9-F11 PolarHBondContact O-N 2.89Š| ||
| 12 | S | 47 | Very low | 51 | Low | 110 Ų | 110 | 145.1 Ų | 145.1 | 77% | 0.769 | 80% | 0.8 | S | S | * | * | trans | -84.7 | 130 | 169.7 | -177 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 13 | P | 57.1 | Low | 51.2 | Low | 119 Ų | 119 | 143.9 Ų | 143.9 | 77% | 0.773 | 79% | 0.793 | S | S | * | * | trans | -101.4 | 103.7 | 162.7 | 11.8 | 7.9 | 0 | 0 | 0 | 110.3 | ||||
| 14 | S | 45.9 | Very low | 51.5 | Low | 98 Ų | 98 | 145.6 Ų | 145.6 | 69% | 0.685 | 80% | 0.796 | S | S | * | * | trans | 24.1 | 117 | 136.9 | -54.5 | 0 | 0 | 0 | 0 | 119.2 | T16 | S14-T16 PolarHBondContact O-N 3.42Š| ||
| 15 | Q | 48.5 | Very low | 51.2 | Low | 200 Ų | 200 | 144.1 Ų | 144.1 | 94% | 0.935 | 80% | 0.795 | S | S | * | * | trans | -58.4 | 115 | 160.9 | -59 | 170.7 | 19.8 | 0 | 0 | 109.7 | ||||
| 16 | T | 52.9 | Low | 51.2 | Low | 121 Ų | 121 | 146.5 Ų | 146.5 | 74% | 0.742 | 80% | 0.799 | S | S | * | * | trans | -109.1 | 111.1 | 164.8 | 49.5 | 0 | 0 | 0 | 0 | 108.6 | S14 | S14-T16 PolarHBondContact O-N 3.42Š| ||
| 17 | S | 43.7 | Very low | 50.6 | Low | 121 Ų | 121 | 144.5 Ų | 144.5 | 85% | 0.846 | 79% | 0.791 | S | S | * | * | trans | -71.5 | 122.5 | 168.5 | 56.4 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 18 | T | 55.8 | Low | 50.6 | Low | 132 Ų | 132 | 145.2 Ų | 145.2 | 81% | 0.81 | 79% | 0.792 | S | S | * | * | trans | -125.4 | 125 | 165.7 | 51.8 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 19 | H | 52.2 | Low | 50.7 | Low | 166 Ų | 166 | 148.9 Ų | 148.9 | 77% | 0.769 | 80% | 0.796 | S | S | * | * | trans | -50.4 | 132.7 | -176.8 | -168.9 | -54.7 | 0 | 0 | 0 | 113.8 | V21 | H19-V21 WeakPolarHBondContact CE1-CG2 3.38Å; H19-V21 WeakPolarHBondContact ND1-CG2 3.37Å; H19-V21 PolarHBondContact O-N 3.08Å | ||
| 20 | N | 44.8 | Very low | 50.6 | Low | 156 Ų | 156 | 152.5 Ų | 152.5 | 83% | 0.834 | 81% | 0.806 | S | S | * | * | trans | -73.9 | 108.8 | 172.8 | -171.3 | -5.2 | 0 | 0 | 0 | 109.9 | ||||
| 21 | V | 50.8 | Low | 50.8 | Low | 100 Ų | 100 | 146.8 Ų | 146.8 | 61% | 0.606 | 79% | 0.793 | S | S | * | * | trans | -150.6 | 130.6 | 159.1 | -151.6 | 0 | 0 | 0 | 0 | 108.5 | H19 | H19-V21 WeakPolarHBondContact CE1-CG2 3.38Å; H19-V21 WeakPolarHBondContact ND1-CG2 3.37Å; H19-V21 PolarHBondContact O-N 3.08Å | ||
| 22 | H | 44.5 | Very low | 51.1 | Low | 162 Ų | 162 | 149.6 Ų | 149.6 | 75% | 0.75 | 80% | 0.798 | S | S | * | * | trans | 60.7 | 98 | 157 | -105.4 | -82.8 | 0 | 0 | 0 | 118.5 | ||||
| 23 | D | 50 | Low | 51.8 | Low | 138 Ų | 138 | 152.5 Ų | 152.5 | 74% | 0.738 | 80% | 0.8 | S | S | * | * | -174 | 125.7 | 101.9 | -106.9 | -19.3 | 0 | 0 | 0 | 113.1 | C25 | D23-C25 PolarHBondContact O-N 3.47Š| |||
| 24 | K | 51.7 | Low | 52 | Low | 209 Ų | 209 | 149.1 Ų | 149.1 | 91% | 0.909 | 78% | 0.779 | S | S | * | * | trans | -77.1 | 61.6 | 171.8 | -68.1 | -176.5 | 176.7 | 178.4 | 0 | 110.3 | ||||
| 25 | C | 47.1 | Very low | 53.4 | Low | 108 Ų | 108 | 151.3 Ų | 151.3 | 73% | 0.73 | 79% | 0.788 | S | S | * | * | trans | -96.5 | 96.4 | 167.6 | -96.9 | 0 | 0 | 0 | 0 | 109.8 | D23 A27 | D23-C25 PolarHBondContact O-N 3.47Å; C25-A27 PolarHBondContact O-N 2.89Å | ||
| 26 | K | 55.1 | Low | 54.7 | Low | 206 Ų | 206 | 146.3 Ų | 146.3 | 90% | 0.896 | 77% | 0.767 | S | S | * | * | trans | -67.4 | 73.6 | 172.5 | -68.9 | -168.2 | 177.4 | -177.8 | 0 | 110.8 | K28 | K26-K28 VanDerWaalsContact C-N 3.33Å; K26-K28 PolarHBondContact O-N 3.31Å | ||
| 27 | A | 47.9 | Very low | 56.3 | Low | 93 Ų | 93 | 144.1 Ų | 144.1 | 77% | 0.769 | 76% | 0.755 | S | S | * | * | trans | -82.9 | 77.7 | 166.9 | 0 | 0 | 0 | 0 | 0 | 109.5 | C25 | C25-A27 PolarHBondContact O-N 2.89Š| ||
| 28 | K | 58.5 | Low | 58.2 | Low | 195 Ų | 195 | 144.4 Ų | 144.4 | 85% | 0.848 | 75% | 0.746 | S | S | * | * | trans | -126.2 | 62.3 | 163.1 | -68 | -167.4 | -179.4 | -172.8 | 0 | 109.3 | K26 H30 | K26-K28 VanDerWaalsContact C-N 3.33Å; K26-K28 PolarHBondContact O-N 3.31Å; K28-H30 VanDerWaalsContact C-N 3.27Å; K28-H30 PolarHBondContact O-N 3.42Å | ||
| 29 | K | 58.2 | Low | 59.7 | Low | 208 Ų | 208 | 144.6 Ų | 144.6 | 90% | 0.904 | 74% | 0.738 | S | S | * | * | trans | -92.6 | 57.7 | 168.3 | -68.4 | -176 | -179.5 | 176.2 | 0 | 109.2 | G31 | K29-G31 PolarHBondContact O-N 3.17Š| ||
| 30 | H | 54.5 | Low | 61.5 | Low | 187 Ų | 187 | 143.3 Ų | 143.3 | 87% | 0.866 | 73% | 0.727 | S | S | * | * | trans | -74.5 | 121.9 | 166.5 | -86.1 | -53.7 | 0 | 0 | 0 | 108.9 | K28 | K28-H30 VanDerWaalsContact C-N 3.27Å; K28-H30 PolarHBondContact O-N 3.42Å | ||
| 31 | G | 48.6 | Very low | 63.5 | Low | 62 Ų | 62 | 140 Ų | 140 | 64% | 0.639 | 70% | 0.703 | S | S | * | * | trans | -25.3 | 129.8 | -174.2 | 0 | 0 | 0 | 0 | 0 | 116.5 | K29 Q33 | K29-G31 PolarHBondContact O-N 3.17Å; G31-Q33 VanDerWaalsContact C-N 3.34Å; G31-Q33 PolarHBondContact O-N 3.02Å | ||
| 32 | R | 58.5 | Low | 65.4 | Low | 251 Ų | 251 | 138.7 Ų | 138.7 | 95% | 0.947 | 69% | 0.693 | S | S | * | * | trans | -51.1 | 100.8 | 159.9 | -77.3 | 178.1 | 165.6 | -124.9 | -0.6 | 108.2 | S34 | R32-S34 PolarHBondContact O-N 3.42Š| ||
| 33 | Q | 60.8 | Low | 67.7 | Low | 171 Ų | 171 | 135.5 Ų | 135.5 | 80% | 0.799 | 68% | 0.678 | S | S | * | * | trans | -48.6 | 108.9 | 162.7 | -72.5 | -92.1 | 4.9 | 0 | 0 | 106.1 | G31 T35 | G31-Q33 VanDerWaalsContact C-N 3.34Å; G31-Q33 PolarHBondContact O-N 3.02Å; Q33-T35 PolarHBondContact O-N 3.44Å | ||
| 34 | S | 62.8 | Low | 69.8 | Low | 47 Ų | 47 | 132.2 Ų | 132.2 | 33% | 0.329 | 66% | 0.663 | S | S | . | * | trans | -58.6 | 130.1 | -177.3 | 131.4 | 0 | 0 | 0 | 0 | 109.2 | R32 I36 R41 | R32-S34 PolarHBondContact O-N 3.42Å; S34-I36 PolarHBondContact O-N 2.95Å; S34-I36 VanDerWaalsContact O-N 3.08Å; S34-I36 VanDerWaalsContact OG-CB 3.27Å; S34-I36 WeakPolarHBondContact OG-CB 3.39Å; S34-I36 WeakPolarHBondContact OG-CG1 3.35Å; S34-I36 PolarHBondContact OG-N 3.48Å; S34-R41 VanDerWaalsContact C-NH2 3.34Å; S34-R41 PolarHBondContact O-NH2 3.05Å; S34-R41 PolarHBondContact OG-NE 3.47Å; S34-R41 VanDerWaalsContact OG-NE 3.1Å; S34-R41 PolarHBondContact OG-NH2 3.41Å | ||
| 35 | T | 75.3 | Confident | 71.8 | Confident | 144 Ų | 144 | 131 Ų | 131 | 88% | 0.883 | 65% | 0.653 | S | S | * | * | trans | -68.9 | -4.5 | 176.5 | -40 | 0 | 0 | 0 | 0 | 112.5 | Q33 P37 | Q33-T35 PolarHBondContact O-N 3.44Å; T35-P37 WeakPolarHBondContact O-CD 3.48Å | ||
| 36 | I | 75.6 | Confident | 74 | Confident | 95 Ų | 95 | 134.1 Ų | 134.1 | 49% | 0.487 | 65% | 0.649 | S | S | . | * | S | Bend | trans | -70.1 | 122.5 | 179.4 | -53 | 170.5 | 0 | 0 | 0 | 109 | S34 R41 | S34-I36 PolarHBondContact O-N 2.95Å; S34-I36 VanDerWaalsContact O-N 3.08Å; S34-I36 VanDerWaalsContact OG-CB 3.27Å; S34-I36 WeakPolarHBondContact OG-CB 3.39Å; S34-I36 WeakPolarHBondContact OG-CG1 3.35Å; S34-I36 PolarHBondContact OG-N 3.48Å; I36-R41 HydrophobicContact CB-CG 4.09Å; I36-R41 HydrophobicContact CG2-CG 3.84Å; I36-R41 PolarHBondContact O-NE 2.89Å |
| 37 | P | 85.8 | Confident | 75.9 | Confident | 76 Ų | 76 | 129.2 Ų | 129.2 | 49% | 0.494 | 63% | 0.632 | S | S | . | * | trans | -56.1 | 143.9 | 177.8 | -19.9 | 29.2 | 0 | 0 | 0 | 111.4 | T35 E39 Y40 R41 | T35-P37 WeakPolarHBondContact O-CD 3.48Å; P37-E39 PolarHBondContact O-N 3.31Å; P37-Y40 HydrophobicContact CB-CD2 3.97Å; P37-Y40 HydrophobicContact CG-CD2 3.84Å; P37-Y40 HydrophobicContact CG-CE2 4.32Å; P37-Y40 PolarHBondContact O-N 2.99Å; P37-R41 PolarHBondContact O-N 3.21Å | ||
| 38 | L | 82.8 | Confident | 78.2 | Confident | 127 Ų | 127 | 132 Ų | 132 | 67% | 0.665 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -54.1 | -38.6 | -175.2 | -69.2 | 172.4 | 0 | 0 | 0 | 112.6 | Y40 R41 D42 | L38-Y40 PolarHBondContact O-N 3.16Å; L38-R41 WeakPolarHBondContact O-CB 3.47Å; L38-R41 PolarHBondContact O-N 3.2Å; L38-R41 VanDerWaalsContact O-N 3.14Å; L38-D42 PolarHBondContact O-N 3.16Å |
| 39 | E | 87.5 | Confident | 80 | Confident | 135 Ų | 135 | 130.5 Ų | 130.5 | 63% | 0.631 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -58.6 | -45.9 | 177.4 | -173.6 | 176.5 | -173.3 | 0 | 0 | 112.7 | P37 R41 D42 Q43 | P37-E39 PolarHBondContact O-N 3.31Å; E39-R41 VanDerWaalsContact C-N 3.32Å; E39-R41 PolarHBondContact O-N 3.03Å; E39-D42 PolarHBondContact O-N 3.06Å; E39-Q43 WeakPolarHBondContact O-CG 3.42Å; E39-Q43 PolarHBondContact O-N 3.41Å |
| 40 | Y | 89.6 | Confident | 81.9 | Confident | 139 Ų | 139 | 125.5 Ų | 125.5 | 55% | 0.545 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -65.1 | -36.4 | 176.3 | -77.9 | -81.9 | 0 | 0 | 0 | 112 | P37 L38 D42 T44 | P37-Y40 HydrophobicContact CB-CD2 3.97Å; P37-Y40 HydrophobicContact CG-CD2 3.84Å; P37-Y40 HydrophobicContact CG-CE2 4.32Å; P37-Y40 PolarHBondContact O-N 2.99Å; L38-Y40 PolarHBondContact O-N 3.16Å; Y40-D42 VanDerWaalsContact C-N 3.34Å; Y40-T44 WeakPolarHBondContact O-CB 3.44Å; Y40-T44 PolarHBondContact O-N 3.01Å; Y40-T44 PolarHBondContact O-OG1 3.44Å |
| 41 | R | 88 | Confident | 83.9 | Confident | 87 Ų | 87 | 120.2 Ų | 120.2 | 33% | 0.328 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -64.3 | -41.8 | 175.5 | -60.5 | -171.9 | -167.7 | -175.6 | 6.5 | 111.1 | S34 I36 P37 L38 E39 T44 R45 | S34-R41 VanDerWaalsContact C-NH2 3.34Å; S34-R41 PolarHBondContact O-NH2 3.05Å; S34-R41 PolarHBondContact OG-NE 3.47Å; S34-R41 VanDerWaalsContact OG-NE 3.1Å; S34-R41 PolarHBondContact OG-NH2 3.41Å; I36-R41 HydrophobicContact CB-CG 4.09Å; I36-R41 HydrophobicContact CG2-CG 3.84Å; I36-R41 PolarHBondContact O-NE 2.89Å; P37-R41 PolarHBondContact O-N 3.21Å; L38-R41 WeakPolarHBondContact O-CB 3.47Å; L38-R41 PolarHBondContact O-N 3.2Å; L38-R41 VanDerWaalsContact O-N 3.14Å; E39-R41 VanDerWaalsContact C-N 3.32Å; E39-R41 PolarHBondContact O-N 3.03Å; R41-T44 PolarHBondContact O-N 2.81Å; R41-R45 WeakPolarHBondContact O-CB 3.14Å; R41-R45 PolarHBondContact O-N 2.94Å |
| 42 | D | 90.8 | Very high | 86.2 | Confident | 73 Ų | 73 | 122.3 Ų | 122.3 | 39% | 0.39 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -70.8 | -40.9 | 178.8 | -79.4 | -15.4 | 0 | 0 | 0 | 112.4 | L38 E39 Y40 T44 R45 R46 | L38-D42 PolarHBondContact O-N 3.16Å; E39-D42 PolarHBondContact O-N 3.06Å; Y40-D42 VanDerWaalsContact C-N 3.34Å; D42-T44 VanDerWaalsContact C-N 3.33Å; D42-T44 PolarHBondContact O-N 3.24Å; D42-R45 PolarHBondContact O-N 3.14Å; D42-R46 WeakPolarHBondContact O-CB 3.19Å; D42-R46 VanDerWaalsContact O-CG 3.23Å; D42-R46 WeakPolarHBondContact O-CG 3.45Å; D42-R46 PolarHBondContact O-N 3.31Å |
| 43 | Q | 93.3 | Very high | 88 | Confident | 94 Ų | 94 | 113 Ų | 113 | 44% | 0.439 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -58.7 | -45.4 | 171.5 | -72.5 | 176.3 | 0.5 | 0 | 0 | 111.2 | E39 R45 R46 L47 | E39-Q43 WeakPolarHBondContact O-CG 3.42Å; E39-Q43 PolarHBondContact O-N 3.41Å; Q43-R45 PolarHBondContact O-N 3.18Å; Q43-R46 PolarHBondContact O-N 3.32Å; Q43-L47 WeakPolarHBondContact O-CB 3.25Å; Q43-L47 PolarHBondContact O-N 3.41Å |
| 44 | T | 93.3 | Very high | 89.8 | Confident | 70 Ų | 70 | 111.9 Ų | 111.9 | 43% | 0.429 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -62.5 | -43 | 176.3 | -58.1 | 0 | 0 | 0 | 0 | 111.5 | Y40 R41 D42 L47 K48 | Y40-T44 WeakPolarHBondContact O-CB 3.44Å; Y40-T44 PolarHBondContact O-N 3.01Å; Y40-T44 PolarHBondContact O-OG1 3.44Å; R41-T44 PolarHBondContact O-N 2.81Å; D42-T44 VanDerWaalsContact C-N 3.33Å; D42-T44 PolarHBondContact O-N 3.24Å; T44-L47 PolarHBondContact O-N 3.2Å; T44-K48 HydrophobicContact CG2-CD 4.25Å; T44-K48 HydrophobicContact CG2-CG 4.43Å; T44-K48 WeakPolarHBondContact O-CB 3.39Å; T44-K48 WeakPolarHBondContact O-CG 3.38Å; T44-K48 PolarHBondContact O-N 2.87Å |
| 45 | R | 92.8 | Very high | 91.5 | Very high | 182 Ų | 182 | 116.9 Ų | 116.9 | 69% | 0.687 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -60.9 | -45.3 | 176.2 | -173.5 | -168.6 | -65 | -104.1 | 3.5 | 111 | R41 D42 Q43 K48 K49 | R41-R45 WeakPolarHBondContact O-CB 3.14Å; R41-R45 PolarHBondContact O-N 2.94Å; D42-R45 PolarHBondContact O-N 3.14Å; Q43-R45 PolarHBondContact O-N 3.18Å; R45-K48 PolarHBondContact O-N 3.28Å; R45-K49 WeakPolarHBondContact O-CB 3.49Å; R45-K49 PolarHBondContact O-N 2.86Å |
| 46 | R | 94.6 | Very high | 92.6 | Very high | 174 Ų | 174 | 116.5 Ų | 116.5 | 66% | 0.657 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -60.4 | -46.5 | 176.5 | -71.2 | 171.4 | -171.5 | -167 | 4.9 | 111.1 | D42 Q43 K49 Q50 | D42-R46 WeakPolarHBondContact O-CB 3.19Å; D42-R46 VanDerWaalsContact O-CG 3.23Å; D42-R46 WeakPolarHBondContact O-CG 3.45Å; D42-R46 PolarHBondContact O-N 3.31Å; Q43-R46 PolarHBondContact O-N 3.32Å; R46-K49 WeakPolarHBondContact O-CB 3.34Å; R46-K49 PolarHBondContact O-N 3.29Å; R46-Q50 WeakPolarHBondContact O-CG 3.39Å; R46-Q50 PolarHBondContact O-N 3.28Å |
| 47 | L | 95.3 | Very high | 93.7 | Very high | 104 Ų | 104 | 119.8 Ų | 119.8 | 55% | 0.545 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -65.1 | -43.3 | 179 | -174.5 | 62.4 | 0 | 0 | 0 | 112.3 | Q43 T44 K49 Q50 N51 | Q43-L47 WeakPolarHBondContact O-CB 3.25Å; Q43-L47 PolarHBondContact O-N 3.41Å; T44-L47 PolarHBondContact O-N 3.2Å; L47-K49 VanDerWaalsContact C-N 3.32Å; L47-K49 PolarHBondContact O-N 3.32Å; L47-Q50 PolarHBondContact O-N 2.94Å; L47-N51 WeakPolarHBondContact O-CB 3.34Å; L47-N51 PolarHBondContact O-N 3.44Å |
| 48 | K | 95.9 | Very high | 94.2 | Very high | 150 Ų | 150 | 118.6 Ų | 118.6 | 65% | 0.652 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -59.8 | -42.6 | 174.1 | -76.4 | -177.8 | 177 | -174.9 | 0 | 111.6 | T44 R45 N51 L52 | T44-K48 HydrophobicContact CG2-CD 4.25Å; T44-K48 HydrophobicContact CG2-CG 4.43Å; T44-K48 WeakPolarHBondContact O-CB 3.39Å; T44-K48 WeakPolarHBondContact O-CG 3.38Å; T44-K48 PolarHBondContact O-N 2.87Å; R45-K48 PolarHBondContact O-N 3.28Å; K48-N51 PolarHBondContact O-N 3.39Å; K48-L52 WeakPolarHBondContact O-CB 3.27Å; K48-L52 PolarHBondContact O-N 3.47Å |
| 49 | K | 96.3 | Very high | 95 | Very high | 165 Ų | 165 | 115 Ų | 115 | 72% | 0.717 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -61.6 | -45.6 | 176 | -171.2 | 178.8 | -178.4 | 179.2 | 0 | 111.5 | R45 R46 L47 E53 | R45-K49 WeakPolarHBondContact O-CB 3.49Å; R45-K49 PolarHBondContact O-N 2.86Å; R46-K49 WeakPolarHBondContact O-CB 3.34Å; R46-K49 PolarHBondContact O-N 3.29Å; L47-K49 VanDerWaalsContact C-N 3.32Å; L47-K49 PolarHBondContact O-N 3.32Å; K49-E53 PolarHBondContact O-N 2.95Å; K49-E53 VanDerWaalsContact O-N 3.11Å |
| 50 | Q | 97 | Very high | 95.4 | Very high | 102 Ų | 102 | 112.5 Ų | 112.5 | 48% | 0.477 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.2 | -44.7 | 175.5 | -72.8 | -177.9 | -2.6 | 0 | 0 | 112.5 | R46 L47 E53 R54 | R46-Q50 WeakPolarHBondContact O-CG 3.39Å; R46-Q50 PolarHBondContact O-N 3.28Å; L47-Q50 PolarHBondContact O-N 2.94Å; Q50-E53 PolarHBondContact O-N 3.48Å; Q50-R54 WeakPolarHBondContact O-CG 3.02Å; Q50-R54 PolarHBondContact O-N 2.95Å |
| 51 | N | 97.4 | Very high | 95.7 | Very high | 76 Ų | 76 | 108.8 Ų | 108.8 | 41% | 0.406 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.6 | -44.4 | 178.8 | -176.8 | -39.1 | 0 | 0 | 0 | 111.4 | L47 K48 E53 R54 R55 | L47-N51 WeakPolarHBondContact O-CB 3.34Å; L47-N51 PolarHBondContact O-N 3.44Å; K48-N51 PolarHBondContact O-N 3.39Å; N51-E53 VanDerWaalsContact C-N 3.29Å; N51-E53 PolarHBondContact O-N 3.38Å; N51-R54 PolarHBondContact O-N 3.49Å; N51-R55 PolarHBondContact O-N 2.86Å; N51-R55 PolarHBondContact OD1-NE 3.17Å |
| 52 | L | 96.4 | Very high | 96.1 | Very high | 107 Ų | 107 | 109.6 Ų | 109.6 | 56% | 0.56 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -57.1 | -43.8 | 174.6 | -176.3 | 65.7 | 0 | 0 | 0 | 111.6 | K48 R55 R56 | K48-L52 WeakPolarHBondContact O-CB 3.27Å; K48-L52 PolarHBondContact O-N 3.47Å; L52-R55 PolarHBondContact O-N 2.91Å; L52-R56 PolarHBondContact O-N 2.89Å |
| 53 | E | 97.6 | Very high | 96.3 | Very high | 56 Ų | 56 | 112.6 Ų | 112.6 | 26% | 0.262 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -66.3 | -40.7 | 176.8 | 177.9 | 57.5 | -164.5 | 0 | 0 | 112.6 | K49 Q50 N51 R55 R56 R57 | K49-E53 PolarHBondContact O-N 2.95Å; K49-E53 VanDerWaalsContact O-N 3.11Å; Q50-E53 PolarHBondContact O-N 3.48Å; N51-E53 VanDerWaalsContact C-N 3.29Å; N51-E53 PolarHBondContact O-N 3.38Å; E53-R55 VanDerWaalsContact C-N 3.33Å; E53-R55 PolarHBondContact O-N 3.44Å; E53-R56 WeakPolarHBondContact O-CB 3.38Å; E53-R56 PolarHBondContact O-N 2.99Å; E53-R56 IonicContact OE1-CZ 3.63Å; E53-R56 IonicContact OE1-NE 3.57Å; E53-R56 IonicContact OE1-NH2 2.82Å; E53-R56 PolarHBondContact OE1-NH2 3.45Å; E53-R56 IonicContact OE2-CZ 3.46Å; E53-R56 IonicContact OE2-NE 2.76Å; E53-R56 PolarHBondContact OE2-NE 3.13Å; E53-R56 IonicContact OE2-NH2 3.33Å; E53-R56 PolarHBondContact OE2-NH2 3.37Å; E53-R57 WeakPolarHBondContact O-CG 3.28Å; E53-R57 PolarHBondContact O-N 3.17Å; E53-R57 IonicContact OE1-CZ 3.74Å; E53-R57 IonicContact OE1-NE 2.91Å; E53-R57 PolarHBondContact OE1-NE 3.4Å; E53-R57 IonicContact OE1-NH2 3.68Å |
| 54 | R | 97.9 | Very high | 96.3 | Very high | 147 Ų | 147 | 111.5 Ų | 111.5 | 56% | 0.555 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -58.8 | -45.6 | 173.9 | -71.2 | -177.3 | -168 | 113.1 | 5.1 | 111.2 | Q50 N51 R56 R57 A58 | Q50-R54 WeakPolarHBondContact O-CG 3.02Å; Q50-R54 PolarHBondContact O-N 2.95Å; N51-R54 PolarHBondContact O-N 3.49Å; R54-R56 PolarHBondContact O-N 3.37Å; R54-R57 PolarHBondContact O-N 2.93Å; R54-A58 PolarHBondContact O-N 2.98Å |
| 55 | R | 98 | Very high | 96.2 | Very high | 151 Ų | 151 | 110.5 Ų | 110.5 | 57% | 0.57 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.9 | -42.1 | 175.5 | -73.8 | -173 | -72.1 | 156.2 | 1.9 | 112.2 | N51 L52 E53 R57 A58 C59 | N51-R55 PolarHBondContact O-N 2.86Å; N51-R55 PolarHBondContact OD1-NE 3.17Å; L52-R55 PolarHBondContact O-N 2.91Å; E53-R55 VanDerWaalsContact C-N 3.33Å; E53-R55 PolarHBondContact O-N 3.44Å; R55-R57 PolarHBondContact O-N 3.26Å; R55-A58 PolarHBondContact O-N 2.93Å; R55-C59 WeakPolarHBondContact O-CB 3.47Å; R55-C59 PolarHBondContact O-N 3.22Å |
| 56 | R | 98.5 | Very high | 96.2 | Very high | 137 Ų | 137 | 104.4 Ų | 104.4 | 52% | 0.517 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -58.5 | -47 | 174.7 | -169.3 | -175 | 74.3 | 103.7 | 4.2 | 111.2 | L52 E53 R54 C59 I60 | L52-R56 PolarHBondContact O-N 2.89Å; E53-R56 WeakPolarHBondContact O-CB 3.38Å; E53-R56 PolarHBondContact O-N 2.99Å; E53-R56 IonicContact OE1-CZ 3.63Å; E53-R56 IonicContact OE1-NE 3.57Å; E53-R56 IonicContact OE1-NH2 2.82Å; E53-R56 PolarHBondContact OE1-NH2 3.45Å; E53-R56 IonicContact OE2-CZ 3.46Å; E53-R56 IonicContact OE2-NE 2.76Å; E53-R56 PolarHBondContact OE2-NE 3.13Å; E53-R56 IonicContact OE2-NH2 3.33Å; E53-R56 PolarHBondContact OE2-NH2 3.37Å; R54-R56 PolarHBondContact O-N 3.37Å; R56-C59 PolarHBondContact O-N 3.28Å; R56-I60 HydrophobicContact CG-CD1 4.14Å; R56-I60 WeakPolarHBondContact O-CG1 3.37Å; R56-I60 PolarHBondContact O-N 3.31Å |
| 57 | R | 98 | Very high | 96.1 | Very high | 164 Ų | 164 | 100.3 Ų | 100.3 | 62% | 0.619 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -63.7 | -44 | 179.5 | -70.9 | 179 | -176.4 | -161.5 | -1.7 | 112.8 | E53 R54 R55 I60 S61 | E53-R57 WeakPolarHBondContact O-CG 3.28Å; E53-R57 PolarHBondContact O-N 3.17Å; E53-R57 IonicContact OE1-CZ 3.74Å; E53-R57 IonicContact OE1-NE 2.91Å; E53-R57 PolarHBondContact OE1-NE 3.4Å; E53-R57 IonicContact OE1-NH2 3.68Å; R54-R57 PolarHBondContact O-N 2.93Å; R55-R57 PolarHBondContact O-N 3.26Å; R57-I60 PolarHBondContact O-N 3.08Å; R57-S61 PolarHBondContact O-N 3.28Å |
| 58 | A | 98 | Very high | 95.9 | Very high | 50 Ų | 50 | 96.1 Ų | 96.1 | 41% | 0.413 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -57.7 | -49.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | R54 R55 I60 S61 D62 | R54-A58 PolarHBondContact O-N 2.98Å; R55-A58 PolarHBondContact O-N 2.93Å; A58-I60 VanDerWaalsContact C-N 3.33Å; A58-I60 PolarHBondContact O-N 3.49Å; A58-S61 WeakPolarHBondContact O-CB 3.37Å; A58-S61 PolarHBondContact O-N 2.89Å; A58-D62 VanDerWaalsContact O-CG 3.22Å; A58-D62 PolarHBondContact O-N 3.23Å |
| 59 | C | 98.1 | Very high | 95.6 | Very high | 53 Ų | 53 | 92.6 Ų | 92.6 | 36% | 0.358 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -59 | -40.2 | 177.8 | -178.4 | 0 | 0 | 0 | 0 | 113.2 | R55 R56 K63 | R55-C59 WeakPolarHBondContact O-CB 3.47Å; R55-C59 PolarHBondContact O-N 3.22Å; R56-C59 PolarHBondContact O-N 3.28Å; C59-K63 WeakPolarHBondContact O-CG 3.27Å; C59-K63 PolarHBondContact O-N 3.09Å; C59-K63 VanDerWaalsContact O-N 3.13Å |
| 60 | I | 97 | Very high | 95.4 | Very high | 82 Ų | 82 | 88.9 Ų | 88.9 | 42% | 0.421 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -62.7 | -46.9 | 175 | -69 | 165.8 | 0 | 0 | 0 | 110.2 | R56 R57 A58 D62 K63 M64 | R56-I60 HydrophobicContact CG-CD1 4.14Å; R56-I60 WeakPolarHBondContact O-CG1 3.37Å; R56-I60 PolarHBondContact O-N 3.31Å; R57-I60 PolarHBondContact O-N 3.08Å; A58-I60 VanDerWaalsContact C-N 3.33Å; A58-I60 PolarHBondContact O-N 3.49Å; I60-D62 PolarHBondContact O-N 2.97Å; I60-K63 PolarHBondContact O-N 3.14Å; I60-M64 HydrophobicContact CG2-CG 4.39Å; I60-M64 WeakPolarHBondContact O-CG 3.49Å; I60-M64 PolarHBondContact O-N 3.07Å |
| 61 | S | 95 | Very high | 95.1 | Very high | 60 Ų | 60 | 84.2 Ų | 84.2 | 42% | 0.42 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -60.2 | -44.6 | 178.6 | -177.6 | 0 | 0 | 0 | 0 | 112 | R57 A58 K63 M64 N65 | R57-S61 PolarHBondContact O-N 3.28Å; A58-S61 WeakPolarHBondContact O-CB 3.37Å; A58-S61 PolarHBondContact O-N 2.89Å; S61-K63 VanDerWaalsContact C-N 3.35Å; S61-K63 PolarHBondContact O-N 3.24Å; S61-M64 PolarHBondContact O-N 2.99Å; S61-N65 WeakPolarHBondContact O-CB 3.46Å; S61-N65 PolarHBondContact O-N 3.38Å; S61-N65 PolarHBondContact O-ND2 3.34Å |
| 62 | D | 96.1 | Very high | 94.7 | Very high | 104 Ų | 104 | 80.8 Ų | 80.8 | 56% | 0.556 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -60.9 | -44.4 | 179.5 | -63.8 | -24.3 | 0 | 0 | 0 | 111.5 | A58 I60 N65 A66 | A58-D62 VanDerWaalsContact O-CG 3.22Å; A58-D62 PolarHBondContact O-N 3.23Å; I60-D62 PolarHBondContact O-N 2.97Å; D62-N65 PolarHBondContact O-N 3.07Å; D62-A66 WeakPolarHBondContact O-CB 3.29Å; D62-A66 PolarHBondContact O-N 3.18Å |
| 63 | K | 95.9 | Very high | 94.3 | Very high | 136 Ų | 136 | 81.1 Ų | 81.1 | 59% | 0.591 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -63.9 | -42.9 | 176 | -72.5 | 177.9 | 178 | -177.2 | 0 | 112.2 | C59 I60 S61 N65 A66 L67 | C59-K63 WeakPolarHBondContact O-CG 3.27Å; C59-K63 PolarHBondContact O-N 3.09Å; C59-K63 VanDerWaalsContact O-N 3.13Å; I60-K63 PolarHBondContact O-N 3.14Å; S61-K63 VanDerWaalsContact C-N 3.35Å; S61-K63 PolarHBondContact O-N 3.24Å; K63-N65 VanDerWaalsContact C-N 3.32Å; K63-N65 PolarHBondContact O-N 2.9Å; K63-A66 PolarHBondContact O-N 2.94Å; K63-L67 WeakPolarHBondContact O-CG 3.41Å; K63-L67 PolarHBondContact O-N 2.81Å |
| 64 | M | 93.5 | Very high | 93.9 | Very high | 71 Ų | 71 | 83.5 Ų | 83.5 | 35% | 0.35 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -63.2 | -39.7 | 177 | -72.1 | -55.1 | -60.1 | 0 | 0 | 111.9 | I60 S61 H68 L91 | I60-M64 HydrophobicContact CG2-CG 4.39Å; I60-M64 WeakPolarHBondContact O-CG 3.49Å; I60-M64 PolarHBondContact O-N 3.07Å; S61-M64 PolarHBondContact O-N 2.99Å; M64-H68 WeakPolarHBondContact O-CB 3.27Å; M64-H68 PolarHBondContact O-N 3.16Å; M64-L91 HydrophobicContact CE-CD1 3.46Å; M64-L91 VanDerWaalsContact CE-CD1 3.46Å |
| 65 | N | 91.7 | Very high | 93.3 | Very high | 49 Ų | 49 | 80.3 Ų | 80.3 | 26% | 0.262 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -66.7 | -44 | 176 | -69.4 | -19.5 | 0 | 0 | 0 | 111.8 | S61 D62 K63 L67 H68 N69 K87 | S61-N65 WeakPolarHBondContact O-CB 3.46Å; S61-N65 PolarHBondContact O-N 3.38Å; S61-N65 PolarHBondContact O-ND2 3.34Å; D62-N65 PolarHBondContact O-N 3.07Å; K63-N65 VanDerWaalsContact C-N 3.32Å; K63-N65 PolarHBondContact O-N 2.9Å; N65-L67 VanDerWaalsContact C-N 3.35Å; N65-L67 PolarHBondContact O-N 3.28Å; N65-H68 PolarHBondContact O-N 2.89Å; N65-N69 VanDerWaalsContact O-CG 3.3Å; N65-N69 PolarHBondContact O-N 3.46Å; N65-K87 PolarHBondContact OD1-NZ 3.24Å |
| 66 | A | 92.7 | Very high | 92.6 | Very high | 54 Ų | 54 | 76.3 Ų | 76.3 | 45% | 0.446 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -60 | -44.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | D62 K63 N69 L70 | D62-A66 WeakPolarHBondContact O-CB 3.29Å; D62-A66 PolarHBondContact O-N 3.18Å; K63-A66 PolarHBondContact O-N 2.94Å; A66-N69 PolarHBondContact O-N 3.07Å; A66-L70 WeakPolarHBondContact O-CB 3.49Å; A66-L70 PolarHBondContact O-N 2.9Å |
| 67 | L | 92.5 | Very high | 91.8 | Very high | 89 Ų | 89 | 73.9 Ų | 73.9 | 47% | 0.466 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -63.3 | -42.5 | 175.6 | -73 | 173.7 | 0 | 0 | 0 | 112.3 | K63 N65 L70 A71 L91 | K63-L67 WeakPolarHBondContact O-CG 3.41Å; K63-L67 PolarHBondContact O-N 2.81Å; N65-L67 VanDerWaalsContact C-N 3.35Å; N65-L67 PolarHBondContact O-N 3.28Å; L67-L70 PolarHBondContact O-N 3.49Å; L67-A71 WeakPolarHBondContact O-CB 3.38Å; L67-A71 PolarHBondContact O-N 2.95Å; L67-L91 HydrophobicContact CB-CD2 4.11Å |
| 68 | H | 89.9 | Confident | 90.8 | Very high | 15 Ų | 15 | 70.8 Ų | 70.8 | 7% | 0.069 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -63.3 | -44.8 | 177 | 172.3 | 78.4 | 0 | 0 | 0 | 112 | M64 N65 L70 A71 M72 K87 | M64-H68 WeakPolarHBondContact O-CB 3.27Å; M64-H68 PolarHBondContact O-N 3.16Å; N65-H68 PolarHBondContact O-N 2.89Å; H68-L70 VanDerWaalsContact C-N 3.34Å; H68-L70 PolarHBondContact O-N 3.41Å; H68-A71 WeakPolarHBondContact O-CB 3.44Å; H68-A71 PolarHBondContact O-N 3.31Å; H68-M72 WeakPolarHBondContact O-CG 3.43Å; H68-M72 PolarHBondContact O-N 2.98Å; H68-K87 HydrophobicContact CB-CD 4.42Å; H68-K87 HydrophobicContact CB-CG 4.42Å |
| 69 | N | 90.4 | Very high | 89.7 | Confident | 76 Ų | 76 | 70.8 Ų | 70.8 | 41% | 0.406 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -64.3 | -40.1 | 176.7 | -68.7 | -12.6 | 0 | 0 | 0 | 111.5 | N65 A66 M72 N73 | N65-N69 VanDerWaalsContact O-CG 3.3Å; N65-N69 PolarHBondContact O-N 3.46Å; A66-N69 PolarHBondContact O-N 3.07Å; N69-M72 PolarHBondContact O-N 3.24Å; N69-N73 WeakPolarHBondContact O-CB 3.37Å; N69-N73 PolarHBondContact O-N 2.66Å; N69-N73 PolarHBondContact O-ND2 3.36Å |
| 70 | L | 92.6 | Very high | 88.6 | Confident | 87 Ų | 87 | 73 Ų | 73 | 46% | 0.455 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -60.6 | -45.7 | 173.4 | 178.6 | 62.4 | 0 | 0 | 0 | 111.3 | A66 L67 H68 M72 N73 L74 | A66-L70 WeakPolarHBondContact O-CB 3.49Å; A66-L70 PolarHBondContact O-N 2.9Å; L67-L70 PolarHBondContact O-N 3.49Å; H68-L70 VanDerWaalsContact C-N 3.34Å; H68-L70 PolarHBondContact O-N 3.41Å; L70-M72 PolarHBondContact O-N 2.9Å; L70-N73 PolarHBondContact O-N 3.48Å; L70-L74 HydrophobicContact CD1-CD1 4.29Å; L70-L74 HydrophobicContact CD1-CG 4.42Å; L70-L74 HydrophobicContact CG-CD1 4.07Å; L70-L74 VanDerWaalsContact O-CG 3.27Å; L70-L74 WeakPolarHBondContact O-CG 3.37Å; L70-L74 PolarHBondContact O-N 3.39Å |
| 71 | A | 90.7 | Very high | 87.2 | Confident | 4 Ų | 4 | 75.7 Ų | 75.7 | 3% | 0.033 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -60.9 | -43.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | L67 H68 L74 I75 I90 L91 | L67-A71 WeakPolarHBondContact O-CB 3.38Å; L67-A71 PolarHBondContact O-N 2.95Å; H68-A71 WeakPolarHBondContact O-CB 3.44Å; H68-A71 PolarHBondContact O-N 3.31Å; A71-L74 PolarHBondContact O-N 2.94Å; A71-I75 VanDerWaalsContact O-CG1 3.29Å; A71-I75 WeakPolarHBondContact O-CG1 3.49Å; A71-I75 PolarHBondContact O-N 2.9Å; A71-I90 HydrophobicContact CB-CG2 3.81Å; A71-L91 HydrophobicContact CB-CD2 4.23Å |
| 72 | M | 88.2 | Confident | 85.9 | Confident | 4 Ų | 4 | 75.9 Ų | 75.9 | 2% | 0.02 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -59.3 | -46.4 | 174.7 | -75.5 | -64.7 | 118.4 | 0 | 0 | 112 | H68 N69 L70 L74 I75 G76 K77 P79 I90 | H68-M72 WeakPolarHBondContact O-CG 3.43Å; H68-M72 PolarHBondContact O-N 2.98Å; N69-M72 PolarHBondContact O-N 3.24Å; L70-M72 PolarHBondContact O-N 2.9Å; M72-L74 VanDerWaalsContact C-N 3.3Å; M72-L74 PolarHBondContact O-N 3.44Å; M72-I75 HydrophobicContact CE-CD1 4.31Å; M72-I75 PolarHBondContact O-N 3.27Å; M72-G76 PolarHBondContact O-N 3Å; M72-K77 CarbonylContact C-O 3.6Å; M72-K77 WeakPolarHBondContact CB-O 3.37Å; M72-K77 PolarHBondContact O-N 3.33Å; M72-K77 HydrophobicContact SD-CB 4.34Å; M72-P79 HydrophobicContact CG-CB 4.1Å; M72-I90 HydrophobicContact CE-CB 4.07Å; M72-I90 HydrophobicContact CE-CD1 3.36Å; M72-I90 HydrophobicContact CE-CG1 3.56Å; M72-I90 HydrophobicContact CE-CG2 3.37Å |
| 73 | N | 88.4 | Confident | 84.5 | Confident | 114 Ų | 114 | 78.7 Ų | 78.7 | 61% | 0.61 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -60.6 | -38.9 | 175.9 | -69.2 | -16.2 | 0 | 0 | 0 | 112.2 | N69 L70 G76 | N69-N73 WeakPolarHBondContact O-CB 3.37Å; N69-N73 PolarHBondContact O-N 2.66Å; N69-N73 PolarHBondContact O-ND2 3.36Å; L70-N73 PolarHBondContact O-N 3.48Å; N73-G76 PolarHBondContact O-N 3.25Å |
| 74 | L | 88.5 | Confident | 83.2 | Confident | 107 Ų | 107 | 82.1 Ų | 82.1 | 56% | 0.56 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -70.3 | -34.7 | 178.5 | -70.6 | 169.2 | 0 | 0 | 0 | 112.8 | L70 A71 M72 G76 F98 | L70-L74 HydrophobicContact CD1-CD1 4.29Å; L70-L74 HydrophobicContact CD1-CG 4.42Å; L70-L74 HydrophobicContact CG-CD1 4.07Å; L70-L74 VanDerWaalsContact O-CG 3.27Å; L70-L74 WeakPolarHBondContact O-CG 3.37Å; L70-L74 PolarHBondContact O-N 3.39Å; A71-L74 PolarHBondContact O-N 2.94Å; M72-L74 VanDerWaalsContact C-N 3.3Å; M72-L74 PolarHBondContact O-N 3.44Å; L74-G76 VanDerWaalsContact C-N 3.28Å; L74-F98 HydrophobicContact CD1-CE2 4.49Å; L74-F98 HydrophobicContact CD1-CZ 3.94Å |
| 75 | I | 85.7 | Confident | 82.3 | Confident | 79 Ų | 79 | 82 Ų | 82 | 41% | 0.405 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -77.1 | -21.2 | 174.5 | -59.2 | 163.1 | 0 | 0 | 0 | 110.8 | A71 M72 K77 I90 | A71-I75 VanDerWaalsContact O-CG1 3.29Å; A71-I75 WeakPolarHBondContact O-CG1 3.49Å; A71-I75 PolarHBondContact O-N 2.9Å; M72-I75 HydrophobicContact CE-CD1 4.31Å; M72-I75 PolarHBondContact O-N 3.27Å; I75-K77 HydrophobicContact CG2-CB 4.4Å; I75-K77 HydrophobicContact CG2-CD 3.62Å; I75-K77 HydrophobicContact CG2-CG 3.93Å; I75-I90 HydrophobicContact CD1-CG2 4.26Å |
| 76 | G | 83.4 | Confident | 81.9 | Confident | 67 Ų | 67 | 85.9 Ų | 85.9 | 69% | 0.691 | 45% | 0.453 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 76.7 | 33 | -176 | 0 | 0 | 0 | 0 | 0 | 112.8 | M72 N73 L74 | M72-G76 PolarHBondContact O-N 3Å; N73-G76 PolarHBondContact O-N 3.25Å; L74-G76 VanDerWaalsContact C-N 3.28Å |
| 77 | K | 81.7 | Confident | 81.6 | Confident | 87 Ų | 87 | 87.6 Ų | 87.6 | 38% | 0.378 | 45% | 0.451 | S | S | . | . | trans | -121 | 146.6 | -178.5 | -75 | 177.6 | 170.1 | -163 | 0 | 110.9 | M72 I75 Y82 | M72-K77 CarbonylContact C-O 3.6Å; M72-K77 WeakPolarHBondContact CB-O 3.37Å; M72-K77 PolarHBondContact O-N 3.33Å; M72-K77 HydrophobicContact SD-CB 4.34Å; I75-K77 HydrophobicContact CG2-CB 4.4Å; I75-K77 HydrophobicContact CG2-CD 3.62Å; I75-K77 HydrophobicContact CG2-CG 3.93Å; K77-Y82 HydrophobicContact CB-CD2 4.1Å; K77-Y82 HydrophobicContact CB-CE2 3.74Å; K77-Y82 HydrophobicContact CD-CD2 4.37Å; K77-Y82 HydrophobicContact CD-CE1 4.21Å; K77-Y82 HydrophobicContact CD-CE2 3.55Å; K77-Y82 VanDerWaalsContact CD-CZ 3.45Å; K77-Y82 WeakPolarHBondContact CD-OH 3.32Å; K77-Y82 WeakPolarHBondContact CE-OH 3.35Å; K77-Y82 HydrophobicContact CG-CE2 3.89Å; K77-Y82 PolarHBondContact NZ-OH 2.93Å | ||
| 78 | D | 77.8 | Confident | 81.4 | Confident | 98 Ų | 98 | 86.9 Ų | 86.9 | 52% | 0.524 | 45% | 0.45 | S | S | . | . | trans | -80.3 | 130.7 | -180 | -73.1 | -34.7 | 0 | 0 | 0 | 111.6 | T80 E81 Y82 | D78-T80 PolarHBondContact O-N 3.37Å; D78-T80 VanDerWaalsContact O-N 3.14Å; D78-E81 HydrophobicContact CB-CG 4.2Å; D78-E81 PolarHBondContact O-N 3.28Å; D78-Y82 WeakPolarHBondContact O-CD2 3.38Å | ||
| 79 | P | 74.6 | Confident | 81.3 | Confident | 50 Ų | 50 | 89.6 Ų | 89.6 | 33% | 0.325 | 47% | 0.465 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.5 | -25.8 | -179.4 | 23.3 | -32.4 | 0 | 0 | 0 | 112.6 | M72 E81 Y82 | M72-P79 HydrophobicContact CG-CB 4.1Å; P79-E81 VanDerWaalsContact C-N 3.29Å; P79-E81 PolarHBondContact O-N 3.38Å; P79-Y82 PolarHBondContact O-N 2.76Å |
| 80 | T | 74.3 | Confident | 81.3 | Confident | 99 Ų | 99 | 86.2 Ų | 86.2 | 61% | 0.607 | 45% | 0.447 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.9 | -18.3 | 178.8 | 49.8 | 0 | 0 | 0 | 0 | 113.3 | D78 H83 | D78-T80 PolarHBondContact O-N 3.37Å; D78-T80 VanDerWaalsContact O-N 3.14Å; T80-H83 PolarHBondContact O-CE1 2.9Å; T80-H83 PolarHBondContact O-ND1 3.07Å |
| 81 | E | 68.1 | Low | 81.2 | Confident | 140 Ų | 140 | 84 Ų | 84 | 65% | 0.654 | 44% | 0.435 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.8 | -19.5 | 178 | -63.4 | -166.9 | 156.5 | 0 | 0 | 112.3 | D78 P79 | D78-E81 HydrophobicContact CB-CG 4.2Å; D78-E81 PolarHBondContact O-N 3.28Å; P79-E81 VanDerWaalsContact C-N 3.29Å; P79-E81 PolarHBondContact O-N 3.38Å |
| 82 | Y | 67 | Low | 81.2 | Confident | 64 Ų | 64 | 87.9 Ų | 87.9 | 25% | 0.251 | 46% | 0.455 | S | S | . | . | trans | -106.8 | 38.8 | -170.6 | -74.3 | -86.4 | 0 | 0 | 0 | 114.7 | K77 D78 P79 K84 I85 | K77-Y82 HydrophobicContact CB-CD2 4.1Å; K77-Y82 HydrophobicContact CB-CE2 3.74Å; K77-Y82 HydrophobicContact CD-CD2 4.37Å; K77-Y82 HydrophobicContact CD-CE1 4.21Å; K77-Y82 HydrophobicContact CD-CE2 3.55Å; K77-Y82 VanDerWaalsContact CD-CZ 3.45Å; K77-Y82 WeakPolarHBondContact CD-OH 3.32Å; K77-Y82 WeakPolarHBondContact CE-OH 3.35Å; K77-Y82 HydrophobicContact CG-CE2 3.89Å; K77-Y82 PolarHBondContact NZ-OH 2.93Å; D78-Y82 WeakPolarHBondContact O-CD2 3.38Å; P79-Y82 PolarHBondContact O-N 2.76Å; Y82-K84 PolarHBondContact O-N 2.78Å; Y82-K84 VanDerWaalsContact O-N 3.08Å; Y82-I85 HydrophobicContact CD1-CD1 3.59Å; Y82-I85 HydrophobicContact CD1-CG1 4.18Å; Y82-I85 HydrophobicContact CE1-CD1 4.09Å; Y82-I85 PolarHBondContact O-N 3.08Å | ||
| 83 | H | 67.1 | Low | 81.3 | Confident | 162 Ų | 162 | 92.1 Ų | 92.1 | 75% | 0.75 | 48% | 0.477 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.4 | -19.3 | 176.4 | -69.8 | 94.8 | 0 | 0 | 0 | 114.6 | T80 | T80-H83 PolarHBondContact O-CE1 2.9Å; T80-H83 PolarHBondContact O-ND1 3.07Å |
| 84 | K | 68.7 | Low | 81.5 | Confident | 209 Ų | 209 | 87.4 Ų | 87.4 | 91% | 0.909 | 45% | 0.453 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.1 | -18.6 | -176.7 | -68.2 | -176.2 | 180 | 178.2 | 0 | 114.3 | Y82 | Y82-K84 PolarHBondContact O-N 2.78Å; Y82-K84 VanDerWaalsContact O-N 3.08Å |
| 85 | I | 74.1 | Confident | 81.7 | Confident | 67 Ų | 67 | 88.3 Ų | 88.3 | 34% | 0.344 | 45% | 0.454 | S | S | . | . | S | Bend | trans | -97.2 | 129.9 | -177.6 | -54.2 | -175.8 | 0 | 0 | 0 | 108.4 | Y82 D89 I90 | Y82-I85 HydrophobicContact CD1-CD1 3.59Å; Y82-I85 HydrophobicContact CD1-CG1 4.18Å; Y82-I85 HydrophobicContact CE1-CD1 4.09Å; Y82-I85 PolarHBondContact O-N 3.08Å; I85-D89 HydrophobicContact CG2-CB 3.74Å; I85-I90 HydrophobicContact CB-CD1 4.01Å; I85-I90 HydrophobicContact CB-CG1 4.32Å; I85-I90 HydrophobicContact CG2-CD1 3.84Å; I85-I90 HydrophobicContact CG2-CG1 3.68Å |
| 86 | E | 83.7 | Confident | 82 | Confident | 131 Ų | 131 | 87.5 Ų | 87.5 | 61% | 0.612 | 46% | 0.455 | S | S | * | . | trans | -65.4 | 142.4 | 178.3 | -62.2 | -168.9 | 173.2 | 0 | 0 | 110.3 | T88 D89 I90 | E86-T88 PolarHBondContact O-N 3.22Å; E86-T88 VanDerWaalsContact O-N 3.09Å; E86-D89 WeakPolarHBondContact O-CB 3.24Å; E86-D89 PolarHBondContact O-N 3.11Å; E86-I90 PolarHBondContact O-N 3.44Å | ||
| 87 | K | 86.6 | Confident | 82.5 | Confident | 91 Ų | 91 | 87.8 Ų | 87.8 | 40% | 0.396 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -52.2 | -36.9 | 177.1 | -68.4 | -177.9 | 176.2 | 166.3 | 0 | 111.5 | N65 H68 L91 | N65-K87 PolarHBondContact OD1-NZ 3.24Å; H68-K87 HydrophobicContact CB-CD 4.42Å; H68-K87 HydrophobicContact CB-CG 4.42Å; K87-L91 VanDerWaalsContact O-CG 3.27Å; K87-L91 WeakPolarHBondContact O-CG 3.24Å; K87-L91 PolarHBondContact O-N 3.36Å; K87-L91 VanDerWaalsContact O-N 3.16Å |
| 88 | T | 87.9 | Confident | 83 | Confident | 74 Ų | 74 | 88.8 Ų | 88.8 | 45% | 0.454 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -62.8 | -41.7 | 177.5 | -46.7 | 0 | 0 | 0 | 0 | 112.1 | E86 L91 N92 | E86-T88 PolarHBondContact O-N 3.22Å; E86-T88 VanDerWaalsContact O-N 3.09Å; T88-L91 PolarHBondContact O-N 3.5Å; T88-N92 WeakPolarHBondContact O-CB 3.06Å; T88-N92 PolarHBondContact O-N 3.05Å; T88-N92 PolarHBondContact O-ND2 3.48Å |
| 89 | D | 88.9 | Confident | 83.7 | Confident | 71 Ų | 71 | 91 Ų | 91 | 38% | 0.38 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -65.2 | -45.2 | -179.5 | -65.7 | -27.1 | 0 | 0 | 0 | 111.5 | I85 E86 L91 N92 I93 | I85-D89 HydrophobicContact CG2-CB 3.74Å; E86-D89 WeakPolarHBondContact O-CB 3.24Å; E86-D89 PolarHBondContact O-N 3.11Å; D89-L91 VanDerWaalsContact C-N 3.31Å; D89-L91 PolarHBondContact O-N 3.36Å; D89-N92 WeakPolarHBondContact O-CB 3.43Å; D89-N92 PolarHBondContact O-N 3.25Å; D89-I93 VanDerWaalsContact O-CG1 3.25Å; D89-I93 WeakPolarHBondContact O-CG1 3.44Å; D89-I93 PolarHBondContact O-N 3.47Å |
| 90 | I | 89.6 | Confident | 84.6 | Confident | 5 Ų | 5 | 93.5 Ų | 93.5 | 3% | 0.026 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -58.3 | -46.6 | 176.1 | -72.2 | 147.2 | 0 | 0 | 0 | 110.6 | A71 M72 I75 I85 E86 N92 I93 C94 | A71-I90 HydrophobicContact CB-CG2 3.81Å; M72-I90 HydrophobicContact CE-CB 4.07Å; M72-I90 HydrophobicContact CE-CD1 3.36Å; M72-I90 HydrophobicContact CE-CG1 3.56Å; M72-I90 HydrophobicContact CE-CG2 3.37Å; I75-I90 HydrophobicContact CD1-CG2 4.26Å; I85-I90 HydrophobicContact CB-CD1 4.01Å; I85-I90 HydrophobicContact CB-CG1 4.32Å; I85-I90 HydrophobicContact CG2-CD1 3.84Å; I85-I90 HydrophobicContact CG2-CG1 3.68Å; E86-I90 PolarHBondContact O-N 3.44Å; I90-N92 VanDerWaalsContact C-N 3.33Å; I90-N92 PolarHBondContact O-N 2.9Å; I90-I93 PolarHBondContact O-N 2.98Å; I90-C94 PolarHBondContact O-N 3.07Å; I90-C94 PolarHBondContact O-SG 2.91Å; I90-C94 VanDerWaalsContact O-SG 3.39Å |
| 91 | L | 90.9 | Very high | 85.4 | Confident | 40 Ų | 40 | 92.2 Ų | 92.2 | 21% | 0.209 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -65 | -38.4 | 178.9 | -67.3 | 173.8 | 0 | 0 | 0 | 111.6 | M64 L67 A71 K87 T88 D89 C94 H95 | M64-L91 HydrophobicContact CE-CD1 3.46Å; M64-L91 VanDerWaalsContact CE-CD1 3.46Å; L67-L91 HydrophobicContact CB-CD2 4.11Å; A71-L91 HydrophobicContact CB-CD2 4.23Å; K87-L91 VanDerWaalsContact O-CG 3.27Å; K87-L91 WeakPolarHBondContact O-CG 3.24Å; K87-L91 PolarHBondContact O-N 3.36Å; K87-L91 VanDerWaalsContact O-N 3.16Å; T88-L91 PolarHBondContact O-N 3.5Å; D89-L91 VanDerWaalsContact C-N 3.31Å; D89-L91 PolarHBondContact O-N 3.36Å; L91-C94 PolarHBondContact O-N 2.99Å; L91-H95 VanDerWaalsContact O-CB 3.27Å; L91-H95 WeakPolarHBondContact O-CB 3.38Å; L91-H95 PolarHBondContact O-N 3.36Å |
| 92 | N | 91.3 | Very high | 86.5 | Confident | 86 Ų | 86 | 89.5 Ų | 89.5 | 46% | 0.46 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -64.2 | -40.5 | 175.1 | -74.6 | -24.1 | 0 | 0 | 0 | 112 | T88 D89 I90 H95 S96 | T88-N92 WeakPolarHBondContact O-CB 3.06Å; T88-N92 PolarHBondContact O-N 3.05Å; T88-N92 PolarHBondContact O-ND2 3.48Å; D89-N92 WeakPolarHBondContact O-CB 3.43Å; D89-N92 PolarHBondContact O-N 3.25Å; I90-N92 VanDerWaalsContact C-N 3.33Å; I90-N92 PolarHBondContact O-N 2.9Å; N92-H95 PolarHBondContact O-N 3.47Å; N92-S96 WeakPolarHBondContact O-CB 3.28Å; N92-S96 PolarHBondContact O-N 3.35Å; N92-S96 PolarHBondContact O-OG 2.82Å |
| 93 | I | 90.3 | Very high | 87.7 | Confident | 94 Ų | 94 | 88.4 Ų | 88.4 | 48% | 0.482 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -62.9 | -52.2 | 175.2 | -68.5 | 162.5 | 0 | 0 | 0 | 109.6 | D89 I90 H95 S96 V97 | D89-I93 VanDerWaalsContact O-CG1 3.25Å; D89-I93 WeakPolarHBondContact O-CG1 3.44Å; D89-I93 PolarHBondContact O-N 3.47Å; I90-I93 PolarHBondContact O-N 2.98Å; I93-H95 VanDerWaalsContact C-N 3.32Å; I93-H95 PolarHBondContact O-N 3.13Å; I93-S96 PolarHBondContact O-N 3.35Å; I93-S96 VanDerWaalsContact O-N 3.13Å; I93-V97 HydrophobicContact CG2-CG2 4.4Å; I93-V97 WeakPolarHBondContact O-CG2 3.3Å; I93-V97 PolarHBondContact O-N 3.05Å |
| 94 | C | 92 | Very high | 88.9 | Confident | 14 Ų | 14 | 84.6 Ų | 84.6 | 10% | 0.095 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -56.7 | -46.3 | 177.4 | -71.3 | 0 | 0 | 0 | 0 | 111.6 | I90 L91 S96 V97 F98 | I90-C94 PolarHBondContact O-N 3.07Å; I90-C94 PolarHBondContact O-SG 2.91Å; I90-C94 VanDerWaalsContact O-SG 3.39Å; L91-C94 PolarHBondContact O-N 2.99Å; C94-S96 VanDerWaalsContact C-N 3.31Å; C94-S96 PolarHBondContact O-N 3.4Å; C94-V97 PolarHBondContact O-N 3.3Å; C94-F98 HydrophobicContact CB-CD2 4.39Å; C94-F98 HydrophobicContact CB-CE2 3.98Å; C94-F98 WeakPolarHBondContact O-CD2 3.44Å; C94-F98 WeakPolarHBondContact O-CG 3.42Å; C94-F98 PolarHBondContact O-N 2.97Å |
| 95 | H | 92.1 | Very high | 90 | Very high | 127 Ų | 127 | 75.6 Ų | 75.6 | 59% | 0.588 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -58.4 | -43 | 177 | 177.1 | -99.5 | 0 | 0 | 0 | 112 | L91 N92 I93 F98 K99 | L91-H95 VanDerWaalsContact O-CB 3.27Å; L91-H95 WeakPolarHBondContact O-CB 3.38Å; L91-H95 PolarHBondContact O-N 3.36Å; N92-H95 PolarHBondContact O-N 3.47Å; I93-H95 VanDerWaalsContact C-N 3.32Å; I93-H95 PolarHBondContact O-N 3.13Å; H95-F98 PolarHBondContact O-N 3.08Å; H95-K99 WeakPolarHBondContact O-CB 3.4Å; H95-K99 PolarHBondContact O-N 3.32Å |
| 96 | S | 92.7 | Very high | 90.7 | Very high | 61 Ų | 61 | 77.9 Ų | 77.9 | 43% | 0.427 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -66.6 | -42.4 | 178.6 | -55.7 | 0 | 0 | 0 | 0 | 112 | N92 I93 C94 K99 N100 | N92-S96 WeakPolarHBondContact O-CB 3.28Å; N92-S96 PolarHBondContact O-N 3.35Å; N92-S96 PolarHBondContact O-OG 2.82Å; I93-S96 PolarHBondContact O-N 3.35Å; I93-S96 VanDerWaalsContact O-N 3.13Å; C94-S96 VanDerWaalsContact C-N 3.31Å; C94-S96 PolarHBondContact O-N 3.4Å; S96-K99 PolarHBondContact O-N 2.92Å; S96-N100 PolarHBondContact O-N 3.46Å; S96-N100 VanDerWaalsContact O-N 3.08Å; S96-N100 PolarHBondContact O-ND2 3.33Å |
| 97 | V | 92.9 | Very high | 91.1 | Very high | 74 Ų | 74 | 78.9 Ų | 78.9 | 45% | 0.448 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -61.7 | -49.1 | 175.5 | 171.7 | 0 | 0 | 0 | 0 | 110.7 | I93 C94 K99 N100 V101 | I93-V97 HydrophobicContact CG2-CG2 4.4Å; I93-V97 WeakPolarHBondContact O-CG2 3.3Å; I93-V97 PolarHBondContact O-N 3.05Å; C94-V97 PolarHBondContact O-N 3.3Å; V97-K99 VanDerWaalsContact C-N 3.33Å; V97-K99 PolarHBondContact O-N 3.3Å; V97-N100 PolarHBondContact O-N 3.21Å; V97-N100 VanDerWaalsContact O-N 3.17Å; V97-V101 HydrophobicContact CG1-CG2 4.34Å; V97-V101 WeakPolarHBondContact O-CG2 3.33Å; V97-V101 PolarHBondContact O-N 3.47Å |
| 98 | F | 92 | Very high | 91.3 | Very high | 107 Ų | 107 | 79 Ų | 79 | 47% | 0.469 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -64.3 | -38.1 | 179.3 | -65.6 | -47.4 | 0 | 0 | 0 | 112.5 | L74 C94 H95 N100 V101 V102 | L74-F98 HydrophobicContact CD1-CE2 4.49Å; L74-F98 HydrophobicContact CD1-CZ 3.94Å; C94-F98 HydrophobicContact CB-CD2 4.39Å; C94-F98 HydrophobicContact CB-CE2 3.98Å; C94-F98 WeakPolarHBondContact O-CD2 3.44Å; C94-F98 WeakPolarHBondContact O-CG 3.42Å; C94-F98 PolarHBondContact O-N 2.97Å; H95-F98 PolarHBondContact O-N 3.08Å; F98-N100 VanDerWaalsContact C-N 3.3Å; F98-N100 PolarHBondContact O-N 2.89Å; F98-V101 PolarHBondContact O-N 3.27Å; F98-V102 WeakPolarHBondContact O-CB 3.2Å; F98-V102 VanDerWaalsContact O-CG2 3.28Å; F98-V102 WeakPolarHBondContact O-CG2 3.37Å; F98-V102 PolarHBondContact O-N 2.91Å |
| 99 | K | 93.1 | Very high | 91.1 | Very high | 146 Ų | 146 | 79.9 Ų | 79.9 | 64% | 0.635 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -58.2 | -43.9 | 173.6 | -174.6 | -179.9 | 176.9 | -177 | 0 | 111.6 | H95 S96 V97 V102 A103 | H95-K99 WeakPolarHBondContact O-CB 3.4Å; H95-K99 PolarHBondContact O-N 3.32Å; S96-K99 PolarHBondContact O-N 2.92Å; V97-K99 VanDerWaalsContact C-N 3.33Å; V97-K99 PolarHBondContact O-N 3.3Å; K99-V102 PolarHBondContact O-N 3.15Å; K99-A103 PolarHBondContact O-N 3.42Å |
| 100 | N | 93.2 | Very high | 91.1 | Very high | 101 Ų | 101 | 81.9 Ų | 81.9 | 54% | 0.54 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -68.8 | -41.1 | 177.7 | -68.8 | -15.8 | 0 | 0 | 0 | 112.3 | S96 V97 F98 V102 A103 I104 | S96-N100 PolarHBondContact O-N 3.46Å; S96-N100 VanDerWaalsContact O-N 3.08Å; S96-N100 PolarHBondContact O-ND2 3.33Å; V97-N100 PolarHBondContact O-N 3.21Å; V97-N100 VanDerWaalsContact O-N 3.17Å; F98-N100 VanDerWaalsContact C-N 3.3Å; F98-N100 PolarHBondContact O-N 2.89Å; N100-V102 VanDerWaalsContact C-N 3.33Å; N100-V102 PolarHBondContact O-N 2.97Å; N100-A103 WeakPolarHBondContact O-CB 3.47Å; N100-A103 PolarHBondContact O-N 2.92Å; N100-I104 WeakPolarHBondContact O-CG1 3.4Å; N100-I104 PolarHBondContact O-N 3Å |
| 101 | V | 92.3 | Very high | 91.1 | Very high | 73 Ų | 73 | 83.4 Ų | 83.4 | 44% | 0.442 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -59.8 | -45.1 | 175 | 171.8 | 0 | 0 | 0 | 0 | 110.6 | V97 F98 A103 I104 V105 | V97-V101 HydrophobicContact CG1-CG2 4.34Å; V97-V101 WeakPolarHBondContact O-CG2 3.33Å; V97-V101 PolarHBondContact O-N 3.47Å; F98-V101 PolarHBondContact O-N 3.27Å; V101-A103 VanDerWaalsContact C-N 3.32Å; V101-A103 PolarHBondContact O-N 3.48Å; V101-I104 PolarHBondContact O-N 3.02Å; V101-V105 HydrophobicContact CG1-CG2 4.26Å; V101-V105 WeakPolarHBondContact O-CB 3.43Å; V101-V105 WeakPolarHBondContact O-CG2 3.46Å; V101-V105 PolarHBondContact O-N 3.49Å |
| 102 | V | 91.4 | Very high | 91 | Very high | 83 Ų | 83 | 84.5 Ų | 84.5 | 50% | 0.503 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -61.3 | -40.6 | 176.2 | 170.1 | 0 | 0 | 0 | 0 | 111.4 | F98 K99 N100 V105 N106 | F98-V102 WeakPolarHBondContact O-CB 3.2Å; F98-V102 VanDerWaalsContact O-CG2 3.28Å; F98-V102 WeakPolarHBondContact O-CG2 3.37Å; F98-V102 PolarHBondContact O-N 2.91Å; K99-V102 PolarHBondContact O-N 3.15Å; N100-V102 VanDerWaalsContact C-N 3.33Å; N100-V102 PolarHBondContact O-N 2.97Å; V102-V105 PolarHBondContact O-N 3.42Å; V102-N106 WeakPolarHBondContact O-CB 3.42Å; V102-N106 PolarHBondContact O-N 3.44Å; V102-N106 PolarHBondContact O-ND2 3.28Å |
| 103 | A | 92.1 | Very high | 90.8 | Very high | 41 Ų | 41 | 86.1 Ų | 86.1 | 34% | 0.339 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -61.2 | -48.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112 | K99 N100 V101 V105 N106 E107 | K99-A103 PolarHBondContact O-N 3.42Å; N100-A103 WeakPolarHBondContact O-CB 3.47Å; N100-A103 PolarHBondContact O-N 2.92Å; V101-A103 VanDerWaalsContact C-N 3.32Å; V101-A103 PolarHBondContact O-N 3.48Å; A103-V105 VanDerWaalsContact C-N 3.33Å; A103-V105 PolarHBondContact O-N 3.28Å; A103-N106 PolarHBondContact O-N 3.31Å; A103-N106 VanDerWaalsContact O-N 3.16Å; A103-E107 WeakPolarHBondContact O-CG 3.49Å; A103-E107 PolarHBondContact O-N 3.3Å |
| 104 | I | 92.3 | Very high | 90.7 | Very high | 81 Ų | 81 | 88.5 Ų | 88.5 | 42% | 0.415 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -60.7 | -43.5 | 178.4 | -66.3 | 164.7 | 0 | 0 | 0 | 111.3 | N100 V101 N106 E107 Q108 I111 | N100-I104 WeakPolarHBondContact O-CG1 3.4Å; N100-I104 PolarHBondContact O-N 3Å; V101-I104 PolarHBondContact O-N 3.02Å; I104-N106 VanDerWaalsContact C-N 3.27Å; I104-N106 PolarHBondContact O-N 3.36Å; I104-E107 PolarHBondContact O-N 3.12Å; I104-Q108 PolarHBondContact O-N 3.08Å; I104-Q108 VanDerWaalsContact O-N 3.14Å; I104-I111 HydrophobicContact CG2-CD1 3.93Å |
| 105 | V | 91 | Very high | 90.5 | Very high | 20 Ų | 20 | 91 Ų | 91 | 12% | 0.121 | 47% | 0.472 | C | S | . | . | H | α-helix | trans | -62.3 | -36.5 | 178.6 | 169 | 0 | 0 | 0 | 0 | 111.3 | V101 V102 A103 I111 L112 V115 | V101-V105 HydrophobicContact CG1-CG2 4.26Å; V101-V105 WeakPolarHBondContact O-CB 3.43Å; V101-V105 WeakPolarHBondContact O-CG2 3.46Å; V101-V105 PolarHBondContact O-N 3.49Å; V102-V105 PolarHBondContact O-N 3.42Å; A103-V105 VanDerWaalsContact C-N 3.33Å; A103-V105 PolarHBondContact O-N 3.28Å; V105-I111 HydrophobicContact CG2-CG2 3.88Å; V105-L112 HydrophobicContact CG1-CB 4.1Å; V105-L112 HydrophobicContact CG1-CD1 3.45Å; V105-L112 VanDerWaalsContact CG1-CD1 3.45Å; V105-L112 HydrophobicContact CG1-CG 4.39Å; V105-V115 HydrophobicContact CG2-CG2 4.16Å |
| 106 | N | 89.1 | Confident | 90.2 | Very high | 115 Ų | 115 | 89 Ų | 89 | 62% | 0.615 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -77.1 | -29.3 | 178.4 | -69.8 | -23.8 | 0 | 0 | 0 | 113.4 | V102 A103 I104 | V102-N106 WeakPolarHBondContact O-CB 3.42Å; V102-N106 PolarHBondContact O-N 3.44Å; V102-N106 PolarHBondContact O-ND2 3.28Å; A103-N106 PolarHBondContact O-N 3.31Å; A103-N106 VanDerWaalsContact O-N 3.16Å; I104-N106 VanDerWaalsContact C-N 3.27Å; I104-N106 PolarHBondContact O-N 3.36Å |
| 107 | E | 91.9 | Very high | 90.1 | Very high | 152 Ų | 152 | 90.2 Ų | 90.2 | 71% | 0.71 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -77.1 | -25.9 | 177.4 | -73.1 | 175.3 | -172.5 | 0 | 0 | 112.8 | A103 I104 | A103-E107 WeakPolarHBondContact O-CG 3.49Å; A103-E107 PolarHBondContact O-N 3.3Å; I104-E107 PolarHBondContact O-N 3.12Å |
| 108 | Q | 89.8 | Confident | 89.9 | Confident | 94 Ų | 94 | 91 Ų | 91 | 44% | 0.439 | 46% | 0.464 | S | S | . | . | trans | -119.7 | 102.9 | -176 | -62.1 | -174.4 | 32.5 | 0 | 0 | 111.6 | I104 D110 I111 L112 | I104-Q108 PolarHBondContact O-N 3.08Å; I104-Q108 VanDerWaalsContact O-N 3.14Å; Q108-D110 PolarHBondContact O-N 3.41Å; Q108-I111 HydrophobicContact CB-CB 4.16Å; Q108-I111 HydrophobicContact CB-CD1 3.94Å; Q108-I111 HydrophobicContact CB-CG1 3.92Å; Q108-I111 HydrophobicContact CG-CD1 4.32Å; Q108-I111 PolarHBondContact O-N 2.76Å; Q108-L112 PolarHBondContact O-N 3.23Å; Q108-L112 VanDerWaalsContact O-N 3.16Å | ||
| 109 | P | 85.2 | Confident | 89.8 | Confident | 92 Ų | 92 | 93.7 Ų | 93.7 | 60% | 0.597 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -61.4 | -33.2 | -177.8 | 24.9 | -33.7 | 0 | 0 | 0 | 112.7 | I111 L112 E113 | P109-I111 VanDerWaalsContact C-N 3.26Å; P109-I111 PolarHBondContact O-N 2.91Å; P109-L112 WeakPolarHBondContact O-CB 3.39Å; P109-L112 PolarHBondContact O-N 3.41Å; P109-E113 PolarHBondContact O-N 3.28Å |
| 110 | D | 89 | Confident | 89.5 | Confident | 114 Ų | 114 | 90.4 Ų | 90.4 | 61% | 0.61 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -64.6 | -29.4 | 177.7 | -57.8 | -8.9 | 0 | 0 | 0 | 112.8 | Q108 R114 | Q108-D110 PolarHBondContact O-N 3.41Å; D110-R114 WeakPolarHBondContact O-CG 3.4Å; D110-R114 PolarHBondContact O-NE 2.9Å |
| 111 | I | 88.6 | Confident | 89.2 | Confident | 36 Ų | 36 | 92 Ų | 92 | 19% | 0.185 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -78.4 | -42.8 | 174.4 | -63.2 | -176.9 | 0 | 0 | 0 | 109.3 | I104 V105 Q108 P109 E113 R114 V115 | I104-I111 HydrophobicContact CG2-CD1 3.93Å; V105-I111 HydrophobicContact CG2-CG2 3.88Å; Q108-I111 HydrophobicContact CB-CB 4.16Å; Q108-I111 HydrophobicContact CB-CD1 3.94Å; Q108-I111 HydrophobicContact CB-CG1 3.92Å; Q108-I111 HydrophobicContact CG-CD1 4.32Å; Q108-I111 PolarHBondContact O-N 2.76Å; P109-I111 VanDerWaalsContact C-N 3.26Å; P109-I111 PolarHBondContact O-N 2.91Å; I111-E113 VanDerWaalsContact C-N 3.33Å; I111-E113 PolarHBondContact O-N 3.38Å; I111-R114 PolarHBondContact O-N 3.32Å; I111-R114 VanDerWaalsContact O-N 3.17Å; I111-V115 HydrophobicContact CG2-CG2 4.12Å; I111-V115 WeakPolarHBondContact O-CG2 3.42Å; I111-V115 PolarHBondContact O-N 3.22Å |
| 112 | L | 88.5 | Confident | 88.8 | Confident | 63 Ų | 63 | 95 Ų | 95 | 33% | 0.33 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -53.6 | -50.4 | 177.3 | -176.4 | 66.7 | 0 | 0 | 0 | 111.3 | V105 Q108 P109 R114 V115 H116 | V105-L112 HydrophobicContact CG1-CB 4.1Å; V105-L112 HydrophobicContact CG1-CD1 3.45Å; V105-L112 VanDerWaalsContact CG1-CD1 3.45Å; V105-L112 HydrophobicContact CG1-CG 4.39Å; Q108-L112 PolarHBondContact O-N 3.23Å; Q108-L112 VanDerWaalsContact O-N 3.16Å; P109-L112 WeakPolarHBondContact O-CB 3.39Å; P109-L112 PolarHBondContact O-N 3.41Å; L112-R114 VanDerWaalsContact C-N 3.33Å; L112-R114 PolarHBondContact O-N 3.17Å; L112-V115 PolarHBondContact O-N 3.38Å; L112-H116 PolarHBondContact O-CD2 2.9Å; L112-H116 VanDerWaalsContact O-CD2 3.22Å; L112-H116 PolarHBondContact O-N 3.08Å |
| 113 | E | 87.8 | Confident | 88.2 | Confident | 121 Ų | 121 | 93.1 Ų | 93.1 | 57% | 0.565 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -58.6 | -44.7 | 178.6 | -167.6 | -174.7 | 165.2 | 0 | 0 | 111.9 | P109 I111 V115 H116 Q117 | P109-E113 PolarHBondContact O-N 3.28Å; I111-E113 VanDerWaalsContact C-N 3.33Å; I111-E113 PolarHBondContact O-N 3.38Å; E113-V115 PolarHBondContact O-N 2.94Å; E113-H116 PolarHBondContact O-N 3.26Å; E113-Q117 WeakPolarHBondContact O-CG 3.46Å; E113-Q117 PolarHBondContact O-N 3.49Å; E113-Q117 PolarHBondContact OE1-NE2 3.45Å |
| 114 | R | 88.7 | Confident | 87.5 | Confident | 143 Ų | 143 | 96.4 Ų | 96.4 | 54% | 0.54 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -63.7 | -38.6 | 177.5 | -73.8 | -175.7 | -72.8 | 172.7 | -4.9 | 112.7 | D110 I111 L112 Q117 L118 | D110-R114 WeakPolarHBondContact O-CG 3.4Å; D110-R114 PolarHBondContact O-NE 2.9Å; I111-R114 PolarHBondContact O-N 3.32Å; I111-R114 VanDerWaalsContact O-N 3.17Å; L112-R114 VanDerWaalsContact C-N 3.33Å; L112-R114 PolarHBondContact O-N 3.17Å; R114-Q117 PolarHBondContact O-N 3.37Å; R114-L118 WeakPolarHBondContact O-CG 3.23Å; R114-L118 PolarHBondContact O-N 3.41Å |
| 115 | V | 87.9 | Confident | 86.7 | Confident | 66 Ų | 66 | 99 Ų | 99 | 40% | 0.4 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -66.6 | -40.4 | 176.1 | 171.5 | 0 | 0 | 0 | 0 | 110.8 | V105 I111 L112 E113 L118 R119 | V105-V115 HydrophobicContact CG2-CG2 4.16Å; I111-V115 HydrophobicContact CG2-CG2 4.12Å; I111-V115 WeakPolarHBondContact O-CG2 3.42Å; I111-V115 PolarHBondContact O-N 3.22Å; L112-V115 PolarHBondContact O-N 3.38Å; E113-V115 PolarHBondContact O-N 2.94Å; V115-L118 PolarHBondContact O-N 3.42Å; V115-R119 WeakPolarHBondContact O-CB 3.46Å; V115-R119 PolarHBondContact O-N 3.36Å |
| 116 | H | 86.1 | Confident | 85.6 | Confident | 87 Ų | 87 | 103.3 Ų | 103.3 | 40% | 0.403 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.6 | -49.1 | 172.9 | -85 | -81 | 0 | 0 | 0 | 111.8 | L112 E113 L118 R119 D120 | L112-H116 PolarHBondContact O-CD2 2.9Å; L112-H116 VanDerWaalsContact O-CD2 3.22Å; L112-H116 PolarHBondContact O-N 3.08Å; E113-H116 PolarHBondContact O-N 3.26Å; H116-L118 VanDerWaalsContact C-N 3.27Å; H116-L118 PolarHBondContact O-N 3.17Å; H116-R119 WeakPolarHBondContact O-CB 3.4Å; H116-R119 PolarHBondContact O-N 3.38Å; H116-R119 VanDerWaalsContact O-N 3.07Å; H116-D120 VanDerWaalsContact O-CG 3.3Å; H116-D120 PolarHBondContact O-N 3.45Å |
| 117 | Q | 89.1 | Confident | 84.6 | Confident | 85 Ų | 85 | 103.3 Ų | 103.3 | 40% | 0.397 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -59 | -37.9 | 176.7 | -69.4 | 175.8 | 16.1 | 0 | 0 | 112.7 | E113 R114 K121 | E113-Q117 WeakPolarHBondContact O-CG 3.46Å; E113-Q117 PolarHBondContact O-N 3.49Å; E113-Q117 PolarHBondContact OE1-NE2 3.45Å; R114-Q117 PolarHBondContact O-N 3.37Å; Q117-K121 WeakPolarHBondContact O-CD 3.34Å; Q117-K121 VanDerWaalsContact O-CG 3.24Å; Q117-K121 WeakPolarHBondContact O-CG 3.43Å; Q117-K121 PolarHBondContact O-N 3.5Å |
| 118 | L | 88.8 | Confident | 83.3 | Confident | 92 Ų | 92 | 98.8 Ų | 98.8 | 48% | 0.482 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -66.2 | -45.8 | 174.4 | -75.7 | 171 | 0 | 0 | 0 | 111.3 | R114 V115 H116 D120 K121 F122 | R114-L118 WeakPolarHBondContact O-CG 3.23Å; R114-L118 PolarHBondContact O-N 3.41Å; V115-L118 PolarHBondContact O-N 3.42Å; H116-L118 VanDerWaalsContact C-N 3.27Å; H116-L118 PolarHBondContact O-N 3.17Å; L118-D120 VanDerWaalsContact C-N 3.29Å; L118-D120 PolarHBondContact O-N 3.08Å; L118-K121 PolarHBondContact O-N 3.38Å; L118-F122 WeakPolarHBondContact O-CD2 3.34Å; L118-F122 PolarHBondContact O-N 3.25Å |
| 119 | R | 89.8 | Confident | 81.9 | Confident | 162 Ų | 162 | 98.9 Ų | 98.9 | 61% | 0.611 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -57 | -42.9 | 177.4 | -179.3 | -172.6 | 174.2 | -165.5 | -3.8 | 111.8 | V115 H116 F122 S123 | V115-R119 WeakPolarHBondContact O-CB 3.46Å; V115-R119 PolarHBondContact O-N 3.36Å; H116-R119 WeakPolarHBondContact O-CB 3.4Å; H116-R119 PolarHBondContact O-N 3.38Å; H116-R119 VanDerWaalsContact O-N 3.07Å; R119-F122 PolarHBondContact O-N 3.11Å; R119-S123 WeakPolarHBondContact O-CB 3.36Å; R119-S123 PolarHBondContact O-N 2.83Å; R119-S123 PolarHBondContact O-OG 3.39Å |
| 120 | D | 86.5 | Confident | 80.5 | Confident | 77 Ų | 77 | 101 Ų | 101 | 41% | 0.412 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -66.3 | -45.6 | -179.9 | -62.8 | -22.2 | 0 | 0 | 0 | 110.5 | H116 L118 F122 S123 D124 | H116-D120 VanDerWaalsContact O-CG 3.3Å; H116-D120 PolarHBondContact O-N 3.45Å; L118-D120 VanDerWaalsContact C-N 3.29Å; L118-D120 PolarHBondContact O-N 3.08Å; D120-F122 VanDerWaalsContact C-N 3.28Å; D120-F122 PolarHBondContact O-N 3.38Å; D120-S123 PolarHBondContact O-N 3.29Å; D120-S123 VanDerWaalsContact O-N 3.07Å; D120-D124 PolarHBondContact O-N 3.3Å |
| 121 | K | 87.7 | Confident | 78.9 | Confident | 136 Ų | 136 | 98 Ų | 98 | 59% | 0.591 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -56.7 | -38.4 | 173.9 | -71.2 | 169.6 | -174.7 | 176.5 | 0 | 113.1 | Q117 L118 K125 | Q117-K121 WeakPolarHBondContact O-CD 3.34Å; Q117-K121 VanDerWaalsContact O-CG 3.24Å; Q117-K121 WeakPolarHBondContact O-CG 3.43Å; Q117-K121 PolarHBondContact O-N 3.5Å; L118-K121 PolarHBondContact O-N 3.38Å; K121-K125 PolarHBondContact O-N 2.96Å |
| 122 | F | 83.2 | Confident | 77.2 | Confident | 135 Ų | 135 | 101.3 Ų | 101.3 | 59% | 0.592 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -73.5 | -38.1 | 176.1 | -77.7 | -66.9 | 0 | 0 | 0 | 112.4 | L118 R119 D120 K125 L126 | L118-F122 WeakPolarHBondContact O-CD2 3.34Å; L118-F122 PolarHBondContact O-N 3.25Å; R119-F122 PolarHBondContact O-N 3.11Å; D120-F122 VanDerWaalsContact C-N 3.28Å; D120-F122 PolarHBondContact O-N 3.38Å; F122-K125 PolarHBondContact O-N 3.15Å; F122-L126 WeakPolarHBondContact O-CG 3.42Å; F122-L126 PolarHBondContact O-N 2.9Å; F122-L126 VanDerWaalsContact O-N 3.08Å |
| 123 | S | 79.9 | Confident | 75.2 | Confident | 44 Ų | 44 | 102.5 Ų | 102.5 | 31% | 0.308 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.8 | -43.8 | 179.2 | -56.8 | 0 | 0 | 0 | 0 | 111.1 | R119 D120 K125 L126 I127 | R119-S123 WeakPolarHBondContact O-CB 3.36Å; R119-S123 PolarHBondContact O-N 2.83Å; R119-S123 PolarHBondContact O-OG 3.39Å; D120-S123 PolarHBondContact O-N 3.29Å; D120-S123 VanDerWaalsContact O-N 3.07Å; S123-K125 VanDerWaalsContact C-N 3.31Å; S123-K125 PolarHBondContact O-N 3.34Å; S123-L126 PolarHBondContact O-N 3.36Å; S123-I127 VanDerWaalsContact O-CG1 3.3Å; S123-I127 WeakPolarHBondContact O-CG1 3.42Å; S123-I127 PolarHBondContact O-N 2.92Å |
| 124 | D | 75.9 | Confident | 73.4 | Confident | 110 Ų | 110 | 101.7 Ų | 101.7 | 59% | 0.588 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -62.2 | -39.3 | 176.7 | -69.5 | -20.6 | 0 | 0 | 0 | 112 | D120 I127 S128 | D120-D124 PolarHBondContact O-N 3.3Å; D124-I127 PolarHBondContact O-N 2.87Å; D124-S128 VanDerWaalsContact O-CB 3.28Å; D124-S128 WeakPolarHBondContact O-CB 3.45Å; D124-S128 PolarHBondContact O-N 3.28Å |
| 125 | K | 75.9 | Confident | 71.6 | Confident | 136 Ų | 136 | 102.5 Ų | 102.5 | 59% | 0.591 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -66 | -42.9 | 178.2 | -167.2 | 174.7 | -179.8 | -169.7 | 0 | 112 | K121 F122 S123 S128 D129 | K121-K125 PolarHBondContact O-N 2.96Å; F122-K125 PolarHBondContact O-N 3.15Å; S123-K125 VanDerWaalsContact C-N 3.31Å; S123-K125 PolarHBondContact O-N 3.34Å; K125-S128 PolarHBondContact O-N 3.47Å; K125-D129 PolarHBondContact O-N 3.45Å; K125-D129 VanDerWaalsContact O-N 3.08Å |
| 126 | L | 69.2 | Low | 69.6 | Low | 109 Ų | 109 | 107 Ų | 107 | 57% | 0.571 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -65.7 | -39.5 | 177.4 | -69.4 | 173.9 | 0 | 0 | 0 | 112.2 | F122 S123 H130 | F122-L126 WeakPolarHBondContact O-CG 3.42Å; F122-L126 PolarHBondContact O-N 2.9Å; F122-L126 VanDerWaalsContact O-N 3.08Å; S123-L126 PolarHBondContact O-N 3.36Å; L126-H130 PolarHBondContact O-CD2 2.86Å; L126-H130 PolarHBondContact O-N 3.28Å |
| 127 | I | 66.7 | Low | 68 | Low | 115 Ų | 115 | 112 Ų | 112 | 59% | 0.59 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -69.1 | -41 | 177.6 | -64.5 | 165.7 | 0 | 0 | 0 | 110.8 | S123 D124 D129 H130 S131 | S123-I127 VanDerWaalsContact O-CG1 3.3Å; S123-I127 WeakPolarHBondContact O-CG1 3.42Å; S123-I127 PolarHBondContact O-N 2.92Å; D124-I127 PolarHBondContact O-N 2.87Å; I127-D129 PolarHBondContact O-N 3.06Å; I127-H130 PolarHBondContact O-N 3.32Å; I127-S131 PolarHBondContact O-N 3.26Å; I127-S131 VanDerWaalsContact O-N 3.08Å |
| 128 | S | 65.4 | Low | 65.9 | Low | 58 Ų | 58 | 117.1 Ų | 117.1 | 41% | 0.406 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -59.1 | -46.6 | 176.7 | -177.9 | 0 | 0 | 0 | 0 | 111.9 | D124 K125 H130 S131 N132 | D124-S128 VanDerWaalsContact O-CB 3.28Å; D124-S128 WeakPolarHBondContact O-CB 3.45Å; D124-S128 PolarHBondContact O-N 3.28Å; K125-S128 PolarHBondContact O-N 3.47Å; S128-H130 VanDerWaalsContact C-N 3.32Å; S128-H130 PolarHBondContact O-N 3.47Å; S128-S131 PolarHBondContact O-N 2.96Å; S128-S131 PolarHBondContact O-OG 3.45Å; S128-N132 PolarHBondContact O-N 2.88Å; S128-N132 PolarHBondContact O-ND2 2.88Å |
| 129 | D | 60 | Low | 63.4 | Low | 96 Ų | 96 | 120.1 Ų | 120.1 | 51% | 0.513 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -66.9 | -32.6 | -178.1 | -69.8 | -20.6 | 0 | 0 | 0 | 112.2 | K125 I127 | K125-D129 PolarHBondContact O-N 3.45Å; K125-D129 VanDerWaalsContact O-N 3.08Å; I127-D129 PolarHBondContact O-N 3.06Å |
| 130 | H | 56.7 | Low | 61.4 | Low | 136 Ų | 136 | 119 Ų | 119 | 63% | 0.63 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -74.5 | -30.1 | 173.9 | -76.6 | -54.2 | 0 | 0 | 0 | 113.8 | L126 I127 S128 N132 | L126-H130 PolarHBondContact O-CD2 2.86Å; L126-H130 PolarHBondContact O-N 3.28Å; I127-H130 PolarHBondContact O-N 3.32Å; S128-H130 VanDerWaalsContact C-N 3.32Å; S128-H130 PolarHBondContact O-N 3.47Å; H130-N132 VanDerWaalsContact C-N 3.32Å; H130-N132 PolarHBondContact O-N 3.37Å |
| 131 | S | 55 | Low | 59.4 | Low | 50 Ų | 50 | 122.4 Ų | 122.4 | 35% | 0.35 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -73 | -22.7 | -179.3 | 77.7 | 0 | 0 | 0 | 0 | 113.9 | I127 S128 K135 | I127-S131 PolarHBondContact O-N 3.26Å; I127-S131 VanDerWaalsContact O-N 3.08Å; S128-S131 PolarHBondContact O-N 2.96Å; S128-S131 PolarHBondContact O-OG 3.45Å; S131-K135 WeakPolarHBondContact O-CE 3.27Å |
| 132 | N | 52.3 | Low | 57 | Low | 106 Ų | 106 | 123.5 Ų | 123.5 | 57% | 0.567 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -90.6 | -24.3 | -178.9 | -68.1 | -33.6 | 0 | 0 | 0 | 113.2 | S128 H130 | S128-N132 PolarHBondContact O-N 2.88Å; S128-N132 PolarHBondContact O-ND2 2.88Å; H130-N132 VanDerWaalsContact C-N 3.32Å; H130-N132 PolarHBondContact O-N 3.37Å |
| 133 | A | 46.7 | Very low | 55 | Low | 89 Ų | 89 | 123.7 Ų | 123.7 | 74% | 0.736 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -77.8 | -17.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||
| 134 | S | 49 | Very low | 53.2 | Low | 104 Ų | 104 | 129.5 Ų | 129.5 | 73% | 0.727 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.7 | 4.5 | -172.7 | -160.6 | 0 | 0 | 0 | 0 | 115.5 | ||
| 135 | K | 51.9 | Low | 51.4 | Low | 160 Ų | 160 | 130.8 Ų | 130.8 | 70% | 0.696 | 68% | 0.683 | S | S | * | * | trans | -93.9 | 7 | -173.4 | -73.3 | 178.9 | -176.2 | 166.6 | 0 | 116.1 | S131 K137 | S131-K135 WeakPolarHBondContact O-CE 3.27Å; K135-K137 PolarHBondContact O-N 3.49Å | ||
| 136 | N | 45.9 | Very low | 49.5 | Very low | 159 Ų | 159 | 130.6 Ų | 130.6 | 85% | 0.85 | 69% | 0.688 | S | S | * | * | trans | -103.5 | 61.4 | 178.4 | -155.5 | -0.1 | 0 | 0 | 0 | 112.3 | ||||
| 137 | K | 51.6 | Low | 48 | Very low | 193 Ų | 193 | 132.9 Ų | 132.9 | 84% | 0.839 | 70% | 0.701 | S | S | * | * | S | Bend | trans | -162.6 | 120.5 | 162.5 | -112.4 | 169.5 | -176.4 | 178 | 0 | 109.3 | K135 | K135-K137 PolarHBondContact O-N 3.49Š|
| 138 | Q | 45.2 | Very low | 46.9 | Very low | 193 Ų | 193 | 132.8 Ų | 132.8 | 90% | 0.902 | 71% | 0.711 | S | S | * | * | trans | 87.6 | 87.5 | 169 | -60.8 | -176 | -30.5 | 0 | 0 | 117.6 | ||||
| 139 | N | 36.4 | Very low | 45.3 | Very low | 154 Ų | 154 | 138.2 Ų | 138.2 | 82% | 0.824 | 74% | 0.736 | S | S | * | * | trans | -51.8 | 154 | 142.4 | -147.6 | -10 | 0 | 0 | 0 | 111.1 | ||||
| 140 | I | 47.5 | Very low | 44.4 | Very low | 139 Ų | 139 | 141 Ų | 141 | 71% | 0.713 | 75% | 0.746 | S | S | * | * | trans | 116.6 | 105.2 | 162.3 | -58.5 | 164.9 | 0 | 0 | 0 | 115.8 | ||||
| 141 | N | 44.8 | Very low | 43.4 | Very low | 149 Ų | 149 | 143.7 Ų | 143.7 | 80% | 0.797 | 76% | 0.755 | S | S | * | * | trans | 93.5 | 97.6 | 148.7 | -64.2 | -9.2 | 0 | 0 | 0 | 121.6 | ||||
| 142 | N | 38.1 | Very low | 42.5 | Very low | 159 Ų | 159 | 149.4 Ų | 149.4 | 85% | 0.85 | 77% | 0.774 | S | S | * | * | trans | -24.4 | 133.5 | 143.8 | -58.7 | -25.1 | 0 | 0 | 0 | 114.8 | ||||
| 143 | N | 40.4 | Very low | 41.7 | Very low | 139 Ų | 139 | 151.3 Ų | 151.3 | 74% | 0.743 | 78% | 0.784 | S | S | * | * | 176.3 | 146.1 | 100.4 | -140.1 | -14.2 | 0 | 0 | 0 | 112.3 | |||||
| 144 | K | 43.4 | Very low | 41.3 | Very low | 165 Ų | 165 | 153.2 Ų | 153.2 | 72% | 0.717 | 79% | 0.786 | S | S | * | * | trans | 72.9 | 101.4 | 153.4 | -78.9 | 170.5 | -179.4 | 178.3 | 0 | 120.9 | ||||
| 145 | N | 36.3 | Very low | 40.6 | Very low | 137 Ų | 137 | 155.7 Ų | 155.7 | 73% | 0.733 | 79% | 0.792 | S | S | * | * | 62.4 | 121.3 | 108.2 | -75.1 | 9.8 | 0 | 0 | 0 | 121.1 | |||||
| 146 | N | 37.8 | Very low | 40.1 | Very low | 132 Ų | 132 | 153.9 Ų | 153.9 | 71% | 0.706 | 79% | 0.794 | S | S | * | * | trans | 104.7 | 111.7 | 133.5 | -62.9 | -10.9 | 0 | 0 | 0 | 118.8 | ||||
| 147 | N | 35.8 | Very low | 39.5 | Very low | 157 Ų | 157 | 156.5 Ų | 156.5 | 84% | 0.84 | 79% | 0.793 | S | S | * | * | trans | 43.8 | 109 | 133 | -70.5 | -5.1 | 0 | 0 | 0 | 118.4 | ||||
| 148 | S | 44.5 | Very low | 39 | Very low | 113 Ų | 113 | 153.8 Ų | 153.8 | 79% | 0.79 | 79% | 0.787 | S | S | * | * | -155 | 123.6 | 128 | 25.6 | 0 | 0 | 0 | 0 | 109.7 | E150 | S148-E150 PolarHBondContact O-N 3.17Š| |||
| 149 | N | 32.3 | Very low | 38.5 | Very low | 173 Ų | 173 | 148.6 Ų | 148.6 | 93% | 0.925 | 77% | 0.77 | S | S | * | * | trans | -64.1 | 110 | 165.8 | -67.2 | -37.5 | 0 | 0 | 0 | 108 | ||||
| 150 | E | 41 | Very low | 38.5 | Very low | 155 Ų | 155 | 152.2 Ų | 152.2 | 72% | 0.724 | 77% | 0.774 | S | S | * | * | trans | -114.3 | 106.7 | 165 | -107.2 | -177.3 | 172.9 | 0 | 0 | 109.8 | S148 F152 | S148-E150 PolarHBondContact O-N 3.17Å; E150-F152 HydrophobicContact CB-CE2 4.26Å; E150-F152 PolarHBondContact O-N 2.88Å | ||
| 151 | K | 35.4 | Very low | 37.9 | Very low | 192 Ų | 192 | 152.5 Ų | 152.5 | 84% | 0.835 | 78% | 0.777 | S | S | * | * | trans | -73.6 | 101.3 | 173.6 | -155.6 | -177 | -171.9 | -169.5 | 0 | 106.4 | D153 | K151-D153 PolarHBondContact O-N 3.24Š| ||
| 152 | F | 35 | Very low | 37.6 | Very low | 170 Ų | 170 | 154.5 Ų | 154.5 | 75% | 0.746 | 78% | 0.781 | S | S | * | * | trans | -81 | 103.9 | 173.6 | -88.8 | -86.9 | 0 | 0 | 0 | 109.3 | E150 V154 | E150-F152 HydrophobicContact CB-CE2 4.26Å; E150-F152 PolarHBondContact O-N 2.88Å; F152-V154 PolarHBondContact O-N 2.93Å | ||
| 153 | D | 36.8 | Very low | 37.5 | Very low | 146 Ų | 146 | 151.7 Ų | 151.7 | 78% | 0.781 | 77% | 0.771 | S | S | * | * | trans | -64.1 | 110.7 | 167.2 | -86.7 | -37.1 | 0 | 0 | 0 | 109.5 | K151 N155 | K151-D153 PolarHBondContact O-N 3.24Å; D153-N155 PolarHBondContact O-N 3.44Å | ||
| 154 | V | 37.8 | Very low | 37.5 | Very low | 128 Ų | 128 | 153.3 Ų | 153.3 | 78% | 0.776 | 78% | 0.779 | S | S | * | * | trans | -83.3 | 89.9 | 173.1 | 179.1 | 0 | 0 | 0 | 0 | 107.7 | F152 | F152-V154 PolarHBondContact O-N 2.93Š| ||
| 155 | N | 35.3 | Very low | 37.4 | Very low | 157 Ų | 157 | 153.4 Ų | 153.4 | 84% | 0.84 | 78% | 0.779 | S | S | * | * | trans | -159.3 | 69.3 | 163.9 | -104.8 | -12.3 | 0 | 0 | 0 | 111 | D153 | D153-N155 PolarHBondContact O-N 3.44Š| ||
| 156 | T | 39.9 | Very low | 37.4 | Very low | 121 Ų | 121 | 155 Ų | 155 | 74% | 0.742 | 79% | 0.785 | S | S | * | * | trans | -118 | 87.3 | 164.7 | -50.7 | 0 | 0 | 0 | 0 | 109 | I158 | T156-I158 HydrophobicContact CG2-CG1 4.15Å; T156-I158 PolarHBondContact O-N 3.2Å; T156-I158 VanDerWaalsContact O-N 3.08Å | ||
| 157 | Y | 34.6 | Very low | 37.7 | Very low | 214 Ų | 214 | 157.8 Ų | 157.8 | 84% | 0.839 | 79% | 0.786 | S | S | * | * | trans | -58 | 101.1 | 160.1 | -165 | -97.2 | 0 | 0 | 0 | 107.5 | P159 | Y157-P159 VanDerWaalsContact O-CD 3.24Å; Y157-P159 WeakPolarHBondContact O-CD 3.27Å | ||
| 158 | I | 41 | Very low | 37.7 | Very low | 136 Ų | 136 | 155.9 Ų | 155.9 | 70% | 0.697 | 79% | 0.785 | S | S | * | * | trans | -83.8 | 109.5 | 174.3 | -59.1 | 176.8 | 0 | 0 | 0 | 107 | T156 | T156-I158 HydrophobicContact CG2-CG1 4.15Å; T156-I158 PolarHBondContact O-N 3.2Å; T156-I158 VanDerWaalsContact O-N 3.08Å | ||
| 159 | P | 33.9 | Very low | 37.6 | Very low | 84 Ų | 84 | 158.2 Ų | 158.2 | 55% | 0.545 | 78% | 0.783 | S | S | . | * | trans | -74.4 | 129.5 | 170.7 | 2 | 17.4 | 0 | 0 | 0 | 107.5 | Y157 N161 | Y157-P159 VanDerWaalsContact O-CD 3.24Å; Y157-P159 WeakPolarHBondContact O-CD 3.27Å; P159-N161 PolarHBondContact O-N 3.14Å | ||
| 160 | Y | 36.5 | Very low | 37.8 | Very low | 231 Ų | 231 | 157 Ų | 157 | 91% | 0.906 | 78% | 0.777 | S | S | * | * | S | Bend | trans | -63.8 | 85.4 | 169.7 | -77.2 | -88.1 | 0 | 0 | 0 | 110 | ||
| 161 | N | 36 | Very low | 37.8 | Very low | 145 Ų | 145 | 157.6 Ų | 157.6 | 78% | 0.775 | 78% | 0.78 | S | S | * | * | trans | -140.7 | 91.5 | 162.1 | -85.3 | -27.3 | 0 | 0 | 0 | 106.5 | P159 P163 | P159-N161 PolarHBondContact O-N 3.14Å; N161-P163 WeakPolarHBondContact O-CD 3.14Å | ||
| 162 | H | 37.4 | Very low | 37.9 | Very low | 190 Ų | 190 | 153.1 Ų | 153.1 | 88% | 0.88 | 77% | 0.772 | S | S | * | * | trans | -85.6 | 110.9 | 164.8 | -104.6 | -67.8 | 0 | 0 | 0 | 108.1 | ||||
| 163 | P | 36.1 | Very low | 38.1 | Very low | 101 Ų | 101 | 152.5 Ų | 152.5 | 66% | 0.656 | 78% | 0.777 | S | S | * | * | trans | -75.9 | 127.5 | 156.2 | 25 | -17.1 | 0 | 0 | 0 | 107.6 | N161 K165 | N161-P163 WeakPolarHBondContact O-CD 3.14Å; P163-K165 PolarHBondContact O-N 2.78Å | ||
| 164 | L | 39.8 | Very low | 37.9 | Very low | 173 Ų | 173 | 152.2 Ų | 152.2 | 91% | 0.906 | 78% | 0.775 | S | S | * | * | trans | -51.6 | 101.6 | 168.7 | -76.9 | 159.6 | 0 | 0 | 0 | 109.1 | M166 | L164-M166 PolarHBondContact O-N 2.93Å; L164-M166 VanDerWaalsContact O-N 3.08Å | ||
| 165 | K | 41.7 | Very low | 38.1 | Very low | 167 Ų | 167 | 156.1 Ų | 156.1 | 73% | 0.726 | 78% | 0.777 | S | S | * | * | trans | -71.5 | 101 | 165.8 | -76.6 | -173.3 | 178.6 | -178.9 | 0 | 107.6 | P163 Y167 | P163-K165 PolarHBondContact O-N 2.78Å; K165-Y167 HydrophobicContact CB-CD2 4.33Å; K165-Y167 HydrophobicContact CB-CE2 4.12Å; K165-Y167 PolarHBondContact O-N 3.44Å; K165-Y167 VanDerWaalsContact O-N 3.15Å | ||
| 166 | M | 37.9 | Very low | 38.2 | Very low | 171 Ų | 171 | 155.4 Ų | 155.4 | 84% | 0.842 | 77% | 0.774 | S | S | * | * | trans | -65.9 | 105.9 | 163.6 | -67.5 | -131.7 | 75 | 0 | 0 | 108 | L164 S168 | L164-M166 PolarHBondContact O-N 2.93Å; L164-M166 VanDerWaalsContact O-N 3.08Å; M166-S168 PolarHBondContact O-N 3.06Å | ||
| 167 | Y | 43.5 | Very low | 38.3 | Very low | 189 Ų | 189 | 157.8 Ų | 157.8 | 74% | 0.741 | 78% | 0.78 | S | S | * | * | trans | -80.4 | 101.9 | 165.6 | -83.7 | -90.3 | 0 | 0 | 0 | 108.3 | K165 H169 | K165-Y167 HydrophobicContact CB-CD2 4.33Å; K165-Y167 HydrophobicContact CB-CE2 4.12Å; K165-Y167 PolarHBondContact O-N 3.44Å; K165-Y167 VanDerWaalsContact O-N 3.15Å; Y167-H169 PolarHBondContact O-N 3.43Å | ||
| 168 | S | 34.6 | Very low | 38.6 | Very low | 117 Ų | 117 | 154.9 Ų | 154.9 | 82% | 0.818 | 78% | 0.779 | S | S | * | * | trans | -72.4 | 105.8 | 152.7 | -81.7 | 0 | 0 | 0 | 0 | 107.6 | M166 | M166-S168 PolarHBondContact O-N 3.06Š| ||
| 169 | H | 43.2 | Very low | 38.6 | Very low | 162 Ų | 162 | 159.7 Ų | 159.7 | 75% | 0.75 | 79% | 0.788 | S | S | * | * | trans | -135.7 | 97.2 | 161.9 | -126 | 56.5 | 0 | 0 | 0 | 108.5 | Y167 H171 | Y167-H169 PolarHBondContact O-N 3.43Å; H169-H171 PolarHBondContact O-N 3.22Å | ||
| 170 | D | 36.2 | Very low | 38.8 | Very low | 147 Ų | 147 | 163.9 Ų | 163.9 | 79% | 0.786 | 80% | 0.801 | S | S | * | * | trans | -53.9 | 113.9 | 151 | -81.9 | -46.5 | 0 | 0 | 0 | 107.3 | ||||
| 171 | H | 41.6 | Very low | 38.6 | Very low | 169 Ų | 169 | 158.8 Ų | 158.8 | 78% | 0.782 | 80% | 0.798 | S | S | * | * | trans | -179.4 | 130.8 | 132.4 | -85.5 | -37.6 | 0 | 0 | 0 | 110 | H169 N173 | H169-H171 PolarHBondContact O-N 3.22Å; H171-N173 PolarHBondContact O-N 3.31Å | ||
| 172 | S | 36.7 | Very low | 38.7 | Very low | 98 Ų | 98 | 158.5 Ų | 158.5 | 69% | 0.685 | 80% | 0.796 | S | S | * | * | trans | -20.6 | 120.7 | 162.6 | 52.3 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 173 | N | 38.7 | Very low | 38.6 | Very low | 157 Ų | 157 | 153.4 Ų | 153.4 | 84% | 0.84 | 78% | 0.782 | S | S | * | * | -175 | 128.3 | 117.7 | -84.8 | -28.5 | 0 | 0 | 0 | 109.3 | H171 | H171-N173 PolarHBondContact O-N 3.31Š| |||
| 174 | D | 34.6 | Very low | 38.7 | Very low | 139 Ų | 139 | 156.4 Ų | 156.4 | 74% | 0.743 | 79% | 0.791 | S | S | * | * | trans | -52.2 | 162.7 | 161.4 | -98.1 | -47.7 | 0 | 0 | 0 | 110.7 | ||||
| 175 | Y | 40.7 | Very low | 38.4 | Very low | 210 Ų | 210 | 155.5 Ų | 155.5 | 82% | 0.824 | 79% | 0.787 | S | S | * | * | trans | 103.7 | 110.4 | 167.5 | -51.9 | -72.7 | 0 | 0 | 0 | 117.6 | ||||
| 176 | D | 37.5 | Very low | 38.1 | Very low | 143 Ų | 143 | 152.5 Ų | 152.5 | 77% | 0.765 | 78% | 0.783 | S | S | * | * | trans | 69.1 | 78.3 | 151.5 | -67.8 | -32.7 | 0 | 0 | 0 | 121.8 | N178 | D176-N178 VanDerWaalsContact C-N 3.32Š| ||
| 177 | I | 42.6 | Very low | 37.9 | Very low | 171 Ų | 171 | 149.1 Ų | 149.1 | 88% | 0.877 | 78% | 0.777 | S | S | * | * | trans | -91.3 | 13.6 | 162.9 | -56.7 | 173.1 | 0 | 0 | 0 | 112.1 | R179 | I177-R179 PolarHBondContact O-N 2.96Š| ||
| 178 | N | 39.9 | Very low | 37.5 | Very low | 152 Ų | 152 | 146.9 Ų | 146.9 | 81% | 0.813 | 78% | 0.776 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.9 | 19 | -171.3 | -127.9 | 2.4 | 0 | 0 | 0 | 115.7 | D176 | D176-N178 VanDerWaalsContact C-N 3.32Š|
| 179 | R | 41.1 | Very low | 37.3 | Very low | 237 Ų | 237 | 145.7 Ų | 145.7 | 89% | 0.894 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118.8 | 0.2 | -169.4 | -114.7 | -179 | -164.4 | -110.9 | 2.1 | 117.8 | I177 | I177-R179 PolarHBondContact O-N 2.96Š|
| 180 | Q | 38.2 | Very low | 37.3 | Very low | 173 Ų | 173 | 144.7 Ų | 144.7 | 81% | 0.808 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -114.2 | 9.1 | -168.3 | -142.8 | 163.4 | 24.6 | 0 | 0 | 116.3 | ||
| 181 | C | 33.1 | Very low | 37.2 | Very low | 124 Ų | 124 | 145.8 Ų | 145.8 | 84% | 0.838 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -99.6 | 3.2 | 176.5 | -65.2 | 0 | 0 | 0 | 0 | 114.7 | ||
| 182 | N | 37.5 | Very low | 37.2 | Very low | 138 Ų | 138 | 145.3 Ų | 145.3 | 74% | 0.738 | 77% | 0.77 | S | S | * | * | S | Bend | trans | -112.1 | 6.2 | -172.8 | -67.6 | -6.8 | 0 | 0 | 0 | 114.8 | ||
| 183 | S | 36 | Very low | 37 | Very low | 83 Ų | 83 | 145.7 Ų | 145.7 | 58% | 0.58 | 77% | 0.772 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.1 | 10 | -171.1 | 71.9 | 0 | 0 | 0 | 0 | 115.9 | ||
| 184 | L | 36.8 | Very low | 37 | Very low | 165 Ų | 165 | 142.9 Ų | 142.9 | 86% | 0.864 | 77% | 0.765 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.4 | 8.2 | 178.1 | -75.6 | 165.2 | 0 | 0 | 0 | 114.2 | ||
| 185 | N | 35.3 | Very low | 36.9 | Very low | 153 Ų | 153 | 144.8 Ų | 144.8 | 82% | 0.818 | 77% | 0.769 | S | S | * | * | trans | -103.4 | 27.8 | 174.2 | -76 | -12.6 | 0 | 0 | 0 | 113 | S187 | N185-S187 PolarHBondContact O-N 3.1Š| ||
| 186 | T | 34.1 | Very low | 36.7 | Very low | 105 Ų | 105 | 142.7 Ų | 142.7 | 64% | 0.644 | 77% | 0.771 | S | S | * | * | trans | -83.1 | 102.5 | 174.1 | 41.4 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 187 | S | 33.3 | Very low | 36.6 | Very low | 100 Ų | 100 | 141.4 Ų | 141.4 | 70% | 0.699 | 77% | 0.769 | S | S | * | * | trans | 64.4 | 76.7 | 138.1 | 52.7 | 0 | 0 | 0 | 0 | 118.3 | N185 | N185-S187 PolarHBondContact O-N 3.1Š| ||
| 188 | I | 35.6 | Very low | 36.1 | Very low | 141 Ų | 141 | 140.5 Ų | 140.5 | 72% | 0.723 | 77% | 0.766 | S | S | * | * | trans | -89.4 | 85.1 | 142.2 | -59.5 | 175.8 | 0 | 0 | 0 | 106 | N190 | I188-N190 PolarHBondContact O-N 3.19Š| ||
| 189 | S | 31.6 | Very low | 36 | Very low | 93 Ų | 93 | 142.1 Ų | 142.1 | 65% | 0.65 | 77% | 0.768 | S | S | * | * | trans | -83.7 | 100.3 | 172.8 | -175.8 | 0 | 0 | 0 | 0 | 108.4 | H191 | S189-H191 PolarHBondContact O-N 3.02Å; S189-H191 VanDerWaalsContact O-N 3.15Å | ||
| 190 | N | 42.6 | Very low | 35.6 | Very low | 140 Ų | 140 | 138.4 Ų | 138.4 | 75% | 0.749 | 77% | 0.766 | S | S | * | * | trans | -78.1 | 92.7 | 170.1 | -74.3 | -19.9 | 0 | 0 | 0 | 108.9 | I188 I192 | I188-N190 PolarHBondContact O-N 3.19Å; N190-I192 PolarHBondContact O-N 3.43Å; N190-I192 VanDerWaalsContact O-N 3.11Å | ||
| 191 | H | 34.2 | Very low | 35.5 | Very low | 170 Ų | 170 | 135.6 Ų | 135.6 | 79% | 0.787 | 77% | 0.766 | S | S | * | * | trans | -72.1 | 90.8 | 162.5 | -111.2 | -87.8 | 0 | 0 | 0 | 108.9 | S189 | S189-H191 PolarHBondContact O-N 3.02Å; S189-H191 VanDerWaalsContact O-N 3.15Å | ||
| 192 | I | 40.7 | Very low | 35.3 | Very low | 160 Ų | 160 | 135.3 Ų | 135.3 | 82% | 0.821 | 77% | 0.765 | S | S | * | * | trans | -112 | 99.5 | 152.2 | -63.8 | 179.6 | 0 | 0 | 0 | 106.5 | N190 | N190-I192 PolarHBondContact O-N 3.43Å; N190-I192 VanDerWaalsContact O-N 3.11Å | ||
| 193 | S | 32.4 | Very low | 35.2 | Very low | 105 Ų | 105 | 133.4 Ų | 133.4 | 73% | 0.734 | 76% | 0.762 | S | S | * | * | trans | -72.7 | 116.2 | 170.7 | -177.8 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 194 | S | 38.5 | Very low | 35.1 | Very low | 98 Ų | 98 | 137.8 Ų | 137.8 | 69% | 0.685 | 77% | 0.773 | S | S | * | * | trans | -166.3 | 110 | 139.7 | -7.7 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 195 | Q | 33.8 | Very low | 35 | Very low | 180 Ų | 180 | 140.2 Ų | 140.2 | 84% | 0.841 | 77% | 0.773 | S | S | * | * | trans | 39.5 | 108.8 | 133.8 | -59.7 | 177.3 | 5.4 | 0 | 0 | 118 | ||||
| 196 | L | 35.4 | Very low | 35 | Very low | 165 Ų | 165 | 142.5 Ų | 142.5 | 86% | 0.864 | 78% | 0.776 | S | S | * | * | -173.3 | 97.5 | 129.6 | -96.5 | 143.7 | 0 | 0 | 0 | 110.8 | |||||
| 197 | T | 35.9 | Very low | 35 | Very low | 116 Ų | 116 | 144.8 Ų | 144.8 | 71% | 0.712 | 78% | 0.784 | S | S | * | * | trans | 24.8 | 116 | 140.8 | 57.4 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 198 | N | 31.4 | Very low | 35.3 | Very low | 153 Ų | 153 | 145.4 Ų | 145.4 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | trans | -19.7 | 126.6 | 148.3 | -64.4 | -35.9 | 0 | 0 | 0 | 116.5 | ||||
| 199 | H | 37.9 | Very low | 35.4 | Very low | 186 Ų | 186 | 146.8 Ų | 146.8 | 86% | 0.861 | 78% | 0.784 | S | S | * | * | trans | -150.4 | 101.8 | 139.5 | -81.3 | -64.3 | 0 | 0 | 0 | 110.5 | ||||
| 200 | N | 32.8 | Very low | 35.9 | Very low | 158 Ų | 158 | 149.9 Ų | 149.9 | 85% | 0.845 | 79% | 0.792 | S | S | * | * | trans | -73.6 | 132.8 | 156.2 | -88 | -25.6 | 0 | 0 | 0 | 108.9 | ||||
| 201 | S | 35.8 | Very low | 35.6 | Very low | 115 Ų | 115 | 150.5 Ų | 150.5 | 80% | 0.804 | 79% | 0.791 | S | S | * | * | trans | 170.2 | 106.9 | 145.9 | -76.2 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 202 | S | 30.5 | Very low | 35.8 | Very low | 117 Ų | 117 | 147.6 Ų | 147.6 | 82% | 0.818 | 79% | 0.79 | S | S | * | * | 58.2 | 102.2 | 94.9 | -171 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 203 | S | 33.8 | Very low | 35.9 | Very low | 99 Ų | 99 | 145.7 Ų | 145.7 | 69% | 0.692 | 79% | 0.786 | S | S | * | * | trans | 177 | 113.8 | 135.7 | 51 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 204 | Q | 35.8 | Very low | 36.4 | Very low | 174 Ų | 174 | 147 Ų | 147 | 81% | 0.813 | 79% | 0.791 | S | S | * | * | 91.1 | 104.4 | 100.6 | -73.8 | -179.1 | 3.3 | 0 | 0 | 113.8 | |||||
| 205 | Y | 33.2 | Very low | 36.6 | Very low | 216 Ų | 216 | 150.2 Ų | 150.2 | 85% | 0.847 | 80% | 0.8 | S | S | * | * | trans | 8.5 | 120.4 | 140 | -64.1 | -88.8 | 0 | 0 | 0 | 118.1 | ||||
| 206 | F | 36 | Very low | 36.8 | Very low | 201 Ų | 201 | 148.3 Ų | 148.3 | 88% | 0.882 | 80% | 0.801 | S | S | * | * | trans | -134.4 | 110.5 | 142.9 | -94.5 | -82.1 | 0 | 0 | 0 | 110.1 | ||||
| 207 | N | 34 | Very low | 37.2 | Very low | 154 Ų | 154 | 146 Ų | 146 | 82% | 0.824 | 80% | 0.798 | S | S | * | * | trans | -91.5 | 116.3 | 168.8 | -134.9 | -38.2 | 0 | 0 | 0 | 106.2 | ||||
| 208 | V | 40.5 | Very low | 37.5 | Very low | 112 Ų | 112 | 150.4 Ų | 150.4 | 68% | 0.679 | 81% | 0.808 | S | S | * | * | trans | -124.8 | 107.6 | 168.2 | -177.9 | 0 | 0 | 0 | 0 | 108.4 | L210 | V208-L210 HydrophobicContact CG1-CD1 4.47Å; V208-L210 HydrophobicContact CG1-CG 4.36Å | ||
| 209 | K | 37.2 | Very low | 38.4 | Very low | 170 Ų | 170 | 153.1 Ų | 153.1 | 74% | 0.739 | 81% | 0.812 | S | S | * | * | trans | -86 | 114.3 | 174.6 | -172 | 164.3 | -174.8 | 172.5 | 0 | 108.1 | ||||
| 210 | L | 41.8 | Very low | 38.3 | Very low | 158 Ų | 158 | 151.5 Ų | 151.5 | 83% | 0.827 | 81% | 0.808 | S | S | * | * | trans | -120.5 | 102.6 | 166.7 | -80.4 | 167.1 | 0 | 0 | 0 | 109.2 | V208 | V208-L210 HydrophobicContact CG1-CD1 4.47Å; V208-L210 HydrophobicContact CG1-CG 4.36Å | ||
| 211 | H | 37 | Very low | 38.8 | Very low | 154 Ų | 154 | 152.1 Ų | 152.1 | 71% | 0.713 | 81% | 0.811 | S | S | * | * | trans | -71.4 | 135.1 | 157.2 | -87.8 | -105.1 | 0 | 0 | 0 | 108.6 | ||||
| 212 | S | 37.8 | Very low | 38.9 | Very low | 109 Ų | 109 | 155.5 Ų | 155.5 | 76% | 0.762 | 81% | 0.811 | S | S | * | * | trans | 173.7 | 112.2 | 132.3 | -75.1 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 213 | T | 43 | Very low | 39.7 | Very low | 120 Ų | 120 | 156.3 Ų | 156.3 | 74% | 0.736 | 81% | 0.811 | S | S | * | * | trans | 31.5 | 127.8 | 144.7 | 56.8 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 214 | P | 41.5 | Very low | 40 | Very low | 131 Ų | 131 | 156.6 Ų | 156.6 | 85% | 0.851 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -88.3 | 119.4 | 161.5 | 32.8 | -26 | 0 | 0 | 0 | 111.4 | ||
| 215 | L | 42.9 | Very low | 40.3 | Very low | 166 Ų | 166 | 153.7 Ų | 153.7 | 87% | 0.869 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -80.9 | 127 | 169.4 | -94 | 152.9 | 0 | 0 | 0 | 110.6 | ||
| 216 | T | 39.4 | Very low | 41 | Very low | 141 Ų | 141 | 150.2 Ų | 150.2 | 87% | 0.865 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -76.1 | 126.5 | 169.6 | -14.3 | 0 | 0 | 0 | 0 | 109.1 | ||
| 217 | S | 43.6 | Very low | 41.1 | Very low | 115 Ų | 115 | 146.9 Ų | 146.9 | 80% | 0.804 | 80% | 0.795 | S | S | * | * | trans | -146.3 | 112.8 | 161 | 56.1 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 218 | K | 42.6 | Very low | 41.9 | Very low | 209 Ų | 209 | 151.1 Ų | 151.1 | 91% | 0.909 | 80% | 0.801 | S | S | * | * | trans | -79.7 | 125.7 | 158.9 | -79.8 | 176.8 | 172.8 | 177.8 | 0 | 107.2 | ||||
| 219 | K | 49.2 | Very low | 41.8 | Very low | 211 Ų | 211 | 152.5 Ų | 152.5 | 92% | 0.917 | 81% | 0.805 | S | S | * | * | trans | -148.4 | 126.1 | 148.4 | -98.9 | -175.5 | -175.3 | 178.6 | 0 | 110.2 | ||||
| 220 | I | 36.8 | Very low | 42.5 | Very low | 152 Ų | 152 | 152.2 Ų | 152.2 | 78% | 0.779 | 81% | 0.81 | S | S | * | * | trans | -77.9 | 135.3 | 172.4 | -67.6 | 158.5 | 0 | 0 | 0 | 107.7 | ||||
| 221 | L | 43.4 | Very low | 42.5 | Very low | 171 Ų | 171 | 153.3 Ų | 153.3 | 90% | 0.895 | 81% | 0.808 | S | S | * | * | trans | -150.6 | 135.2 | 151.2 | -145.7 | 76.1 | 0 | 0 | 0 | 110.4 | ||||
| 222 | K | 36.6 | Very low | 43.1 | Very low | 185 Ų | 185 | 151.5 Ų | 151.5 | 80% | 0.804 | 81% | 0.81 | S | S | * | * | trans | -95.2 | 140.8 | -179.6 | -65.7 | 170.8 | 171.7 | 179.1 | 0 | 109.8 | ||||
| 223 | T | 47.6 | Very low | 43.5 | Very low | 135 Ų | 135 | 153.8 Ų | 153.8 | 83% | 0.828 | 81% | 0.812 | S | S | * | * | trans | -160.3 | 99.1 | 152.3 | 47.8 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 224 | S | 41.4 | Very low | 43.7 | Very low | 105 Ų | 105 | 154 Ų | 154 | 73% | 0.734 | 81% | 0.812 | S | S | * | * | 66.1 | 118.9 | 87.5 | -156 | 0 | 0 | 0 | 0 | 115.4 | |||||
| 225 | T | 41.3 | Very low | 43.9 | Very low | 113 Ų | 113 | 153.9 Ų | 153.9 | 69% | 0.693 | 81% | 0.809 | S | S | * | * | trans | 62.2 | 129.3 | 150.6 | 22.7 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 226 | D | 46.9 | Very low | 44.1 | Very low | 142 Ų | 142 | 152.1 Ų | 152.1 | 76% | 0.759 | 81% | 0.806 | S | S | * | * | cis | -156.5 | 155 | 42.5 | -84.8 | -50.2 | 0 | 0 | 0 | 114.3 | ||||
| 227 | N | 38.7 | Very low | 44 | Very low | 132 Ų | 132 | 151.4 Ų | 151.4 | 71% | 0.706 | 81% | 0.806 | S | S | * | * | trans | -15.5 | 134.4 | 165.2 | -73 | -49.2 | 0 | 0 | 0 | 120 | ||||
| 228 | Y | 51.8 | Low | 44.2 | Very low | 242 Ų | 242 | 156.3 Ų | 156.3 | 95% | 0.949 | 81% | 0.809 | S | S | * | * | -154.3 | 131.9 | 117.7 | -90.3 | -73.2 | 0 | 0 | 0 | 110.8 | |||||
| 229 | N | 37.7 | Very low | 44.1 | Very low | 142 Ų | 142 | 149.2 Ų | 149.2 | 76% | 0.759 | 79% | 0.785 | S | S | * | * | trans | -67.5 | 123.8 | -174.3 | -107.9 | -49.9 | 0 | 0 | 0 | 113.8 | ||||
| 230 | I | 51.1 | Low | 43.8 | Very low | 164 Ų | 164 | 148 Ų | 148 | 84% | 0.841 | 78% | 0.783 | S | S | * | * | trans | -141.5 | 114.1 | 150.3 | -56.2 | -178.7 | 0 | 0 | 0 | 108.2 | ||||
| 231 | K | 41.8 | Very low | 44 | Very low | 181 Ų | 181 | 146.8 Ų | 146.8 | 79% | 0.787 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 135.4 | 179 | -69.4 | 176.9 | 175.9 | 179.9 | 0 | 111 | ||
| 232 | P | 50.6 | Low | 44.1 | Very low | 116 Ų | 116 | 147.1 Ų | 147.1 | 75% | 0.753 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -83.9 | 124.7 | 158.5 | 30.4 | -25.8 | 0 | 0 | 0 | 109.8 | V234 | P232-V234 PolarHBondContact O-N 3.35Š|
| 233 | I | 45.1 | Very low | 44.7 | Very low | 157 Ų | 157 | 145.6 Ų | 145.6 | 81% | 0.805 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 123 | 167.2 | -90.7 | 166.3 | 0 | 0 | 0 | 108.5 | T235 | I233-T235 HydrophobicContact CG2-CG2 4.36Š|
| 234 | V | 46.8 | Very low | 44.5 | Very low | 124 Ų | 124 | 144.2 Ų | 144.2 | 75% | 0.752 | 79% | 0.786 | S | S | * | * | trans | -101 | 113.4 | 166.4 | 173.9 | 0 | 0 | 0 | 0 | 106.5 | P232 | P232-V234 PolarHBondContact O-N 3.35Š| ||
| 235 | T | 47 | Very low | 44.5 | Very low | 128 Ų | 128 | 142.3 Ų | 142.3 | 79% | 0.785 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -85.3 | 123.5 | 168.5 | 26.3 | 0 | 0 | 0 | 0 | 109.3 | I233 | I233-T235 HydrophobicContact CG2-CG2 4.36Š|
| 236 | T | 45.8 | Very low | 44.8 | Very low | 130 Ų | 130 | 144.7 Ų | 144.7 | 80% | 0.798 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -73.4 | 144.2 | -172.9 | 42.9 | 0 | 0 | 0 | 0 | 113.8 | ||
| 237 | S | 38.6 | Very low | 45.2 | Very low | 125 Ų | 125 | 146 Ų | 146 | 87% | 0.874 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 144 | 169.1 | -33 | 0 | 0 | 0 | 0 | 112.2 | ||
| 238 | Y | 46.6 | Very low | 45.5 | Very low | 219 Ų | 219 | 146.6 Ų | 146.6 | 86% | 0.859 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -97 | 124.8 | -178.2 | -178.9 | -100.6 | 0 | 0 | 0 | 111.4 | ||
| 239 | S | 41.7 | Very low | 45.3 | Very low | 59 Ų | 59 | 141.6 Ų | 141.6 | 41% | 0.413 | 79% | 0.789 | S | S | . | * | trans | 59.2 | 112.1 | 142.5 | -49.8 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 240 | Q | 42.3 | Very low | 45.9 | Very low | 187 Ų | 187 | 140.8 Ų | 140.8 | 87% | 0.874 | 79% | 0.789 | S | S | * | * | 98.2 | 108.9 | 85.4 | -80.8 | 179.7 | 28.9 | 0 | 0 | 112.1 | |||||
| 241 | S | 42.1 | Very low | 45.5 | Very low | 126 Ų | 126 | 140 Ų | 140 | 88% | 0.881 | 79% | 0.787 | S | S | * | * | trans | -165.2 | 133.7 | 131.3 | 59.8 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 242 | L | 44 | Very low | 45.6 | Very low | 177 Ų | 177 | 138 Ų | 138 | 93% | 0.927 | 79% | 0.79 | S | S | * | * | trans | -88.5 | 137.7 | 172.8 | -68.9 | 156.7 | 0 | 0 | 0 | 107.9 | ||||
| 243 | D | 50.3 | Low | 45 | Very low | 153 Ų | 153 | 141.3 Ų | 141.3 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | trans | -159.4 | 144 | 139.9 | -151.5 | -7.6 | 0 | 0 | 0 | 111.4 | ||||
| 244 | S | 42.9 | Very low | 44.9 | Very low | 106 Ų | 106 | 141.7 Ų | 141.7 | 74% | 0.741 | 80% | 0.798 | S | S | * | * | trans | -26.6 | 154.8 | 170.1 | 54.4 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 245 | G | 40.6 | Very low | 44.5 | Very low | 65 Ų | 65 | 142.9 Ų | 142.9 | 67% | 0.67 | 80% | 0.801 | S | S | * | * | cis | 136.7 | 151.2 | 25.1 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 246 | I | 47.6 | Very low | 44.3 | Very low | 164 Ų | 164 | 144.1 Ų | 144.1 | 84% | 0.841 | 80% | 0.8 | S | S | * | * | trans | 97.1 | 96.9 | 164 | -46.6 | 160.9 | 0 | 0 | 0 | 117.9 | ||||
| 247 | E | 55.5 | Low | 44.2 | Very low | 169 Ų | 169 | 143 Ų | 143 | 79% | 0.79 | 80% | 0.798 | S | S | * | * | 47.5 | 120 | 125.2 | -57.9 | -175.4 | 175 | 0 | 0 | 123.6 | |||||
| 248 | D | 45 | Very low | 44 | Very low | 145 Ų | 145 | 147.4 Ų | 147.4 | 78% | 0.775 | 80% | 0.797 | S | S | * | * | 43 | 116.7 | 126.3 | -62.1 | -18.7 | 0 | 0 | 0 | 121.5 | |||||
| 249 | T | 48.9 | Very low | 43.9 | Very low | 136 Ų | 136 | 146.9 Ų | 146.9 | 83% | 0.834 | 80% | 0.799 | S | S | * | * | -170.8 | 115.2 | 124.9 | 15.2 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 250 | V | 49.5 | Very low | 43.6 | Very low | 125 Ų | 125 | 149.7 Ų | 149.7 | 76% | 0.758 | 82% | 0.819 | S | S | * | * | 50.6 | 107.6 | 129.8 | -169.4 | 0 | 0 | 0 | 0 | 120.5 | |||||
| 251 | N | 42.2 | Very low | 43.4 | Very low | 149 Ų | 149 | 149.6 Ų | 149.6 | 80% | 0.797 | 82% | 0.819 | S | S | * | * | trans | 16.6 | 125.1 | 132.3 | -67.7 | -21.6 | 0 | 0 | 0 | 119.4 | ||||
| 252 | T | 43.5 | Very low | 43.1 | Very low | 138 Ų | 138 | 149.1 Ų | 149.1 | 85% | 0.847 | 82% | 0.815 | S | S | * | * | -155 | 122 | 127 | -65 | 0 | 0 | 0 | 0 | 110.1 | |||||
| 253 | Q | 38.3 | Very low | 42.9 | Very low | 186 Ų | 186 | 148.2 Ų | 148.2 | 87% | 0.869 | 81% | 0.81 | S | S | * | * | trans | -94.5 | 123 | 177.8 | -178.3 | 178.7 | 55.6 | 0 | 0 | 108.2 | ||||
| 254 | L | 44.1 | Very low | 42.2 | Very low | 165 Ų | 165 | 148.3 Ų | 148.3 | 86% | 0.864 | 81% | 0.81 | S | S | * | * | trans | -136.8 | 119.8 | 161.7 | -95.4 | 171 | 0 | 0 | 0 | 110.7 | ||||
| 255 | N | 37.6 | Very low | 41.8 | Very low | 149 Ų | 149 | 148.6 Ų | 148.6 | 80% | 0.797 | 81% | 0.811 | S | S | * | * | trans | -92.4 | 126.2 | -173.3 | -161.3 | 3 | 0 | 0 | 0 | 107.7 | ||||
| 256 | I | 43.7 | Very low | 41.5 | Very low | 153 Ų | 153 | 151.8 Ų | 151.8 | 79% | 0.785 | 82% | 0.818 | S | S | * | * | trans | -130.5 | 117.6 | 169.4 | -51.8 | 179.9 | 0 | 0 | 0 | 109.6 | ||||
| 257 | S | 42.6 | Very low | 41.1 | Very low | 108 Ų | 108 | 152.8 Ų | 152.8 | 76% | 0.755 | 82% | 0.819 | S | S | * | * | trans | -68.3 | 139.7 | -177.6 | 179.5 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 258 | Y | 35.2 | Very low | 40.2 | Very low | 217 Ų | 217 | 149.4 Ų | 149.4 | 85% | 0.851 | 81% | 0.814 | S | S | * | * | trans | -75.9 | 141.3 | 169.3 | -59.8 | -88.1 | 0 | 0 | 0 | 111.4 | ||||
| 259 | K | 43.6 | Very low | 39.9 | Very low | 207 Ų | 207 | 148.5 Ų | 148.5 | 90% | 0.9 | 82% | 0.816 | S | S | * | * | trans | -140.3 | 110.5 | 161.1 | -127.6 | -179 | -174.6 | 180 | 0 | 109.1 | ||||
| 260 | S | 37.1 | Very low | 39.6 | Very low | 118 Ų | 118 | 150.5 Ų | 150.5 | 83% | 0.825 | 82% | 0.816 | S | S | * | * | trans | -78.1 | 133.4 | 173.3 | -48.7 | 0 | 0 | 0 | 0 | 110 | ||||
| 261 | Q | 37.7 | Very low | 38.8 | Very low | 186 Ų | 186 | 152.3 Ų | 152.3 | 87% | 0.869 | 82% | 0.82 | S | S | * | * | trans | -130.5 | 117.8 | 163.4 | -99.4 | 174.2 | -5.5 | 0 | 0 | 109.3 | ||||
| 262 | S | 36.1 | Very low | 38.7 | Very low | 116 Ų | 116 | 153.4 Ų | 153.4 | 81% | 0.811 | 83% | 0.825 | S | S | * | * | trans | -74.3 | 131.2 | 170.3 | 50.7 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 263 | I | 39.8 | Very low | 38.5 | Very low | 157 Ų | 157 | 154.7 Ų | 154.7 | 81% | 0.805 | 82% | 0.821 | S | S | * | * | trans | -117.3 | 111.6 | 168.9 | -55.7 | 174.4 | 0 | 0 | 0 | 107.4 | ||||
| 264 | N | 34.5 | Very low | 38.4 | Very low | 155 Ų | 155 | 154.4 Ų | 154.4 | 83% | 0.829 | 82% | 0.822 | S | S | * | * | trans | -71.6 | 130.5 | 163.1 | -75.1 | -35.4 | 0 | 0 | 0 | 108.3 | ||||
| 265 | C | 33.8 | Very low | 38.1 | Very low | 112 Ų | 112 | 150.9 Ų | 150.9 | 76% | 0.757 | 81% | 0.811 | S | S | * | * | trans | -132.5 | 102.2 | 162.3 | -157.1 | 0 | 0 | 0 | 0 | 109 | ||||
| 266 | T | 35.4 | Very low | 38 | Very low | 133 Ų | 133 | 153 Ų | 153 | 82% | 0.816 | 82% | 0.816 | S | S | * | * | trans | -76.7 | 121.4 | 163.6 | 40 | 0 | 0 | 0 | 0 | 109 | ||||
| 267 | Q | 39.4 | Very low | 38 | Very low | 184 Ų | 184 | 157 Ų | 157 | 86% | 0.86 | 82% | 0.822 | S | S | * | * | trans | -148 | 116.7 | 157.4 | -109.1 | 172.1 | 16.6 | 0 | 0 | 111.5 | ||||
| 268 | S | 36.6 | Very low | 37.7 | Very low | 99 Ų | 99 | 158.5 Ų | 158.5 | 69% | 0.692 | 82% | 0.82 | S | S | * | * | trans | -15.5 | 143.2 | 163.6 | -179.6 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 269 | P | 39.1 | Very low | 38.1 | Very low | 125 Ų | 125 | 157.9 Ų | 157.9 | 81% | 0.812 | 82% | 0.822 | S | S | * | * | trans | -82.3 | 125.9 | 169.6 | 32.8 | -27.9 | 0 | 0 | 0 | 111 | ||||
| 270 | Q | 41.1 | Very low | 38 | Very low | 179 Ų | 179 | 156.4 Ų | 156.4 | 84% | 0.836 | 82% | 0.815 | S | S | * | * | trans | -110.6 | 108.9 | 164 | -74.7 | -167 | -7.1 | 0 | 0 | 110.2 | ||||
| 271 | L | 34.1 | Very low | 38 | Very low | 162 Ų | 162 | 159.1 Ų | 159.1 | 85% | 0.848 | 82% | 0.815 | S | S | * | * | trans | 13.1 | 108.4 | 136.3 | -85.7 | 147.3 | 0 | 0 | 0 | 116.8 | ||||
| 272 | L | 39.2 | Very low | 38 | Very low | 173 Ų | 173 | 157.4 Ų | 157.4 | 91% | 0.906 | 81% | 0.812 | S | S | * | * | trans | -130.6 | 97.3 | 146.8 | -96.8 | 167.1 | 0 | 0 | 0 | 109.3 | M274 | L272-M274 PolarHBondContact O-N 3.48Š| ||
| 273 | H | 40.2 | Very low | 37.9 | Very low | 164 Ų | 164 | 162.1 Ų | 162.1 | 76% | 0.759 | 81% | 0.813 | S | S | * | * | trans | -70.6 | 112.3 | 166.7 | 176.9 | -97.2 | 0 | 0 | 0 | 108.5 | ||||
| 274 | M | 36.6 | Very low | 37.9 | Very low | 181 Ų | 181 | 165.9 Ų | 165.9 | 89% | 0.892 | 82% | 0.819 | S | S | * | * | trans | -137.3 | 99 | 162.1 | -124 | -158.1 | -179.4 | 0 | 0 | 111.8 | L272 | L272-M274 PolarHBondContact O-N 3.48Š| ||
| 275 | S | 37.2 | Very low | 37.7 | Very low | 90 Ų | 90 | 164.1 Ų | 164.1 | 63% | 0.629 | 81% | 0.81 | S | S | * | * | trans | 37.7 | 96.5 | 142.9 | -56.1 | 0 | 0 | 0 | 0 | 118.7 | R277 | S275-R277 PolarHBondContact O-N 3.49Š| ||
| 276 | Q | 36.1 | Very low | 38.1 | Very low | 194 Ų | 194 | 166.8 Ų | 166.8 | 91% | 0.907 | 81% | 0.814 | S | S | * | * | trans | -57.9 | 117.6 | 153.4 | -71.8 | 168.1 | 0.9 | 0 | 0 | 110 | ||||
| 277 | R | 42.5 | Very low | 38.2 | Very low | 237 Ų | 237 | 166.3 Ų | 166.3 | 89% | 0.894 | 81% | 0.807 | S | S | * | * | trans | -105.5 | 112.4 | 156.8 | -77.7 | -165.7 | -157.2 | 169.7 | 7.9 | 109.5 | S275 F279 | S275-R277 PolarHBondContact O-N 3.49Å; R277-F279 PolarHBondContact O-N 3.08Å | ||
| 278 | I | 36.6 | Very low | 38 | Very low | 139 Ų | 139 | 166.3 Ų | 166.3 | 71% | 0.713 | 81% | 0.807 | S | S | * | * | trans | -53.2 | 123 | 169.5 | -63.6 | 158 | 0 | 0 | 0 | 109.8 | K280 | I278-K280 HydrophobicContact CG2-CG 4.02Š| ||
| 279 | F | 42.6 | Very low | 38 | Very low | 204 Ų | 204 | 166.1 Ų | 166.1 | 90% | 0.895 | 80% | 0.804 | S | S | * | * | trans | -120.3 | 106.3 | 150.4 | -105.8 | -83.4 | 0 | 0 | 0 | 108.4 | R277 | R277-F279 PolarHBondContact O-N 3.08Š| ||
| 280 | K | 41.6 | Very low | 38 | Very low | 176 Ų | 176 | 166.1 Ų | 166.1 | 77% | 0.765 | 80% | 0.801 | S | S | * | * | trans | -65.1 | 131.9 | 167.4 | -70.4 | 173.5 | 172.7 | 179.1 | 0 | 108.9 | I278 | I278-K280 HydrophobicContact CG2-CG 4.02Š| ||
| 281 | Q | 38.8 | Very low | 37.9 | Very low | 176 Ų | 176 | 165.3 Ų | 165.3 | 82% | 0.822 | 80% | 0.797 | S | S | * | * | trans | 168 | 103.6 | 131.5 | -97 | 170.2 | -7.2 | 0 | 0 | 110.5 | ||||
| 282 | N | 36.5 | Very low | 38.1 | Very low | 150 Ų | 150 | 164 Ų | 164 | 80% | 0.802 | 79% | 0.791 | S | S | * | * | 160.6 | 107.8 | 114.5 | -79.9 | -29 | 0 | 0 | 0 | 109.6 | |||||
| 283 | Y | 34 | Very low | 38.1 | Very low | 214 Ų | 214 | 163.7 Ų | 163.7 | 84% | 0.839 | 79% | 0.785 | S | S | * | * | trans | -60.8 | 127.4 | 166 | -86.6 | -105.3 | 0 | 0 | 0 | 109.7 | ||||
| 284 | Y | 39.4 | Very low | 38.1 | Very low | 237 Ų | 237 | 162.8 Ų | 162.8 | 93% | 0.929 | 78% | 0.784 | S | S | * | * | trans | -148.5 | 116.5 | 133.3 | -87.8 | -71.7 | 0 | 0 | 0 | 108.4 | ||||
| 285 | N | 30.8 | Very low | 38 | Very low | 117 Ų | 117 | 160.2 Ų | 160.2 | 63% | 0.626 | 78% | 0.782 | S | S | * | * | trans | -89.8 | 122.6 | 176.2 | 174.4 | -9.6 | 0 | 0 | 0 | 107.9 | N287 | N285-N287 PolarHBondContact OD1-N 3.25Å; N285-N287 PolarHBondContact OD1-OD1 2.62Å | ||
| 286 | I | 41.4 | Very low | 38.3 | Very low | 168 Ų | 168 | 164.7 Ų | 164.7 | 86% | 0.862 | 79% | 0.793 | S | S | * | * | trans | -136.9 | 114.2 | 150.9 | -63.1 | -176.6 | 0 | 0 | 0 | 107.7 | ||||
| 287 | N | 38.2 | Very low | 38.7 | Very low | 123 Ų | 123 | 164 Ų | 164 | 66% | 0.658 | 79% | 0.791 | S | S | * | * | trans | -60.9 | 147.3 | 176.5 | -57.1 | -64.1 | 0 | 0 | 0 | 113.2 | N285 | N285-N287 PolarHBondContact OD1-N 3.25Å; N285-N287 PolarHBondContact OD1-OD1 2.62Å | ||
| 288 | Q | 36.5 | Very low | 38.7 | Very low | 184 Ų | 184 | 160.5 Ų | 160.5 | 86% | 0.86 | 79% | 0.788 | S | S | * | * | trans | 135.5 | 146.3 | 133 | -74.4 | -127.7 | 18.1 | 0 | 0 | 115.2 | ||||
| 289 | P | 36.1 | Very low | 39.2 | Very low | 96 Ų | 96 | 160.4 Ų | 160.4 | 62% | 0.623 | 79% | 0.787 | S | S | * | * | -119.8 | 167.3 | -125.9 | 42.5 | -32.9 | 0 | 0 | 0 | 114.4 | |||||
| 290 | V | 37.8 | Very low | 39.1 | Very low | 125 Ų | 125 | 157.5 Ų | 157.5 | 76% | 0.758 | 78% | 0.781 | S | S | * | * | trans | 62.7 | 118.1 | 141.3 | 175.4 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 291 | E | 39.4 | Very low | 39.2 | Very low | 162 Ų | 162 | 155.2 Ų | 155.2 | 76% | 0.757 | 78% | 0.776 | S | S | * | * | -166.8 | 144.9 | 76.7 | -76.4 | 177.1 | 175 | 0 | 0 | 110.6 | |||||
| 292 | N | 37.9 | Very low | 39.6 | Very low | 135 Ų | 135 | 151.8 Ų | 151.8 | 72% | 0.722 | 77% | 0.772 | S | S | * | * | trans | 42.4 | 127.8 | 140.3 | -53.7 | -15.3 | 0 | 0 | 0 | 117.7 | ||||
| 293 | E | 40 | Very low | 40 | Very low | 166 Ų | 166 | 153.4 Ų | 153.4 | 78% | 0.776 | 77% | 0.772 | S | S | * | * | 173.8 | 157.1 | 51.1 | -136.3 | 167.6 | -164.6 | 0 | 0 | 108 | |||||
| 294 | I | 40.6 | Very low | 40.8 | Very low | 145 Ų | 145 | 152.8 Ų | 152.8 | 74% | 0.744 | 77% | 0.774 | S | S | * | * | trans | 85.7 | 101.3 | 158.9 | -55.1 | 157.9 | 0 | 0 | 0 | 117.4 | E296 | I294-E296 PolarHBondContact O-N 2.94Š| ||
| 295 | C | 34.3 | Very low | 41.2 | Very low | 126 Ų | 126 | 150.9 Ų | 150.9 | 85% | 0.851 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 119.8 | 161.2 | -70.9 | 0 | 0 | 0 | 0 | 111.3 | ||
| 296 | E | 43.5 | Very low | 41.6 | Very low | 184 Ų | 184 | 153.5 Ų | 153.5 | 86% | 0.86 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -100.6 | 122.5 | 155.1 | -81.5 | -160.9 | 162 | 0 | 0 | 110.3 | I294 | I294-E296 PolarHBondContact O-N 2.94Š|
| 297 | Q | 44 | Very low | 42.2 | Very low | 181 Ų | 181 | 154.7 Ų | 154.7 | 85% | 0.846 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 131.7 | 179.7 | -74.1 | 166.4 | -1.5 | 0 | 0 | 111.6 | I299 | Q297-I299 PolarHBondContact O-N 2.83Å; Q297-I299 VanDerWaalsContact O-N 3.17Å |
| 298 | I | 42.1 | Very low | 42.6 | Very low | 162 Ų | 162 | 156.8 Ų | 156.8 | 83% | 0.831 | 78% | 0.784 | S | S | * | * | trans | -66.4 | 107.9 | 168.4 | -63.2 | 169 | 0 | 0 | 0 | 107.8 | D300 | I298-D300 PolarHBondContact O-N 3.4Š| ||
| 299 | I | 47 | Very low | 42.8 | Very low | 138 Ų | 138 | 153.9 Ų | 153.9 | 71% | 0.708 | 78% | 0.778 | S | S | * | * | trans | -80.1 | 101.8 | 165.5 | -64 | 173.8 | 0 | 0 | 0 | 107.4 | Q297 L301 | Q297-I299 PolarHBondContact O-N 2.83Å; Q297-I299 VanDerWaalsContact O-N 3.17Å; I299-L301 HydrophobicContact CG2-CD1 3.72Å; I299-L301 HydrophobicContact CG2-CG 3.71Å; I299-L301 PolarHBondContact O-N 3.4Å | ||
| 300 | D | 42.2 | Very low | 43 | Very low | 143 Ų | 143 | 157.1 Ų | 157.1 | 77% | 0.765 | 79% | 0.791 | S | S | * | * | trans | -84.8 | 95.2 | 169.9 | -161.3 | 6.7 | 0 | 0 | 0 | 109.2 | I298 S302 | I298-D300 PolarHBondContact O-N 3.4Å; D300-S302 PolarHBondContact O-N 3.32Å | ||
| 301 | L | 43 | Very low | 43.2 | Very low | 127 Ų | 127 | 159.3 Ų | 159.3 | 67% | 0.665 | 79% | 0.792 | S | S | * | * | trans | -90.6 | 87.5 | 175.2 | -85 | 156.7 | 0 | 0 | 0 | 109.8 | I299 F303 | I299-L301 HydrophobicContact CG2-CD1 3.72Å; I299-L301 HydrophobicContact CG2-CG 3.71Å; I299-L301 PolarHBondContact O-N 3.4Å; L301-F303 HydrophobicContact CD2-CE2 4.19Å; L301-F303 PolarHBondContact O-N 3.49Å | ||
| 302 | S | 47.8 | Very low | 43.5 | Very low | 105 Ų | 105 | 160.2 Ų | 160.2 | 73% | 0.734 | 80% | 0.796 | S | S | * | * | trans | -73.2 | 103.2 | 164.3 | 54.1 | 0 | 0 | 0 | 0 | 110.2 | D300 K304 | D300-S302 PolarHBondContact O-N 3.32Å; S302-K304 PolarHBondContact O-N 3.17Å | ||
| 303 | F | 44.4 | Very low | 43.7 | Very low | 184 Ų | 184 | 161.8 Ų | 161.8 | 81% | 0.807 | 80% | 0.799 | S | S | * | * | trans | -89 | 96 | 168 | -94.9 | -84.3 | 0 | 0 | 0 | 110.2 | L301 K305 | L301-F303 HydrophobicContact CD2-CE2 4.19Å; L301-F303 PolarHBondContact O-N 3.49Å; F303-K305 PolarHBondContact O-N 2.78Å | ||
| 304 | K | 50.2 | Low | 44.1 | Very low | 200 Ų | 200 | 162.4 Ų | 162.4 | 87% | 0.87 | 80% | 0.801 | S | S | * | * | trans | -80.9 | 100.4 | 164.6 | -136.7 | 176.7 | -173.5 | 179.3 | 0 | 107.7 | S302 | S302-K304 PolarHBondContact O-N 3.17Š| ||
| 305 | K | 48.2 | Very low | 44.2 | Very low | 198 Ų | 198 | 162.8 Ų | 162.8 | 86% | 0.861 | 80% | 0.8 | S | S | * | * | trans | -94.8 | 98.2 | 175.1 | -157.1 | 178.4 | -173.5 | -177.8 | 0 | 108.8 | F303 | F303-K305 PolarHBondContact O-N 2.78Š| ||
| 306 | Q | 40.1 | Very low | 44.7 | Very low | 172 Ų | 172 | 166.3 Ų | 166.3 | 80% | 0.804 | 80% | 0.804 | S | S | * | * | trans | -104 | 112.1 | 166.9 | -172.4 | 166.6 | 9 | 0 | 0 | 106.9 | ||||
| 307 | K | 52.9 | Low | 44.7 | Very low | 192 Ų | 192 | 164.5 Ų | 164.5 | 84% | 0.835 | 80% | 0.795 | S | S | * | * | trans | -134 | 111.4 | 169 | -148.9 | 176.9 | -175.4 | -175.3 | 0 | 108.2 | ||||
| 308 | Q | 47.4 | Very low | 44.7 | Very low | 168 Ų | 168 | 163.8 Ų | 163.8 | 79% | 0.785 | 80% | 0.796 | S | S | * | * | trans | -61.1 | 138.1 | 174 | -73.9 | 169.7 | -10.2 | 0 | 0 | 110.1 | ||||
| 309 | T | 39.1 | Very low | 44.8 | Very low | 122 Ų | 122 | 163.7 Ų | 163.7 | 75% | 0.748 | 79% | 0.791 | S | S | * | * | trans | -87.7 | 124.9 | 166.4 | 50 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 310 | N | 42.3 | Very low | 44.7 | Very low | 164 Ų | 164 | 165.3 Ų | 165.3 | 88% | 0.877 | 80% | 0.796 | S | S | * | * | trans | -127.1 | 114.9 | 156.2 | -97.5 | -31.4 | 0 | 0 | 0 | 107.6 | ||||
| 311 | H | 41.5 | Very low | 44.9 | Very low | 171 Ų | 171 | 164.3 Ų | 164.3 | 79% | 0.792 | 80% | 0.795 | S | S | * | * | trans | -77.7 | 126.6 | 173.4 | -87.5 | -79.9 | 0 | 0 | 0 | 109.7 | ||||
| 312 | H | 44.6 | Very low | 44.9 | Very low | 182 Ų | 182 | 168.9 Ų | 168.9 | 84% | 0.843 | 81% | 0.809 | S | S | * | * | trans | -150.5 | 127.5 | 137.2 | -131.7 | 57 | 0 | 0 | 0 | 109.9 | ||||
| 313 | H | 43.4 | Very low | 45.1 | Very low | 167 Ų | 167 | 171.8 Ų | 171.8 | 77% | 0.773 | 81% | 0.812 | S | S | * | * | trans | -110.8 | 122.7 | -172.9 | -146.4 | 53.9 | 0 | 0 | 0 | 105.4 | ||||
| 314 | H | 47.2 | Very low | 45.4 | Very low | 180 Ų | 180 | 170.8 Ų | 170.8 | 83% | 0.833 | 81% | 0.809 | S | S | * | * | trans | -131.7 | 126.6 | 157.4 | -115.9 | -60.4 | 0 | 0 | 0 | 108.5 | ||||
| 315 | H | 42.6 | Very low | 45.3 | Very low | 153 Ų | 153 | 170 Ų | 170 | 71% | 0.708 | 81% | 0.809 | S | S | * | * | trans | -54.7 | 138.4 | 179 | -118.2 | -103.3 | 0 | 0 | 0 | 112.8 | ||||
| 316 | E | 45.6 | Very low | 45 | Very low | 200 Ų | 200 | 168.1 Ų | 168.1 | 94% | 0.935 | 81% | 0.808 | S | S | * | * | -161.6 | 149.1 | 128.1 | -114.5 | 172.9 | -173.7 | 0 | 0 | 111 | |||||
| 317 | E | 42.6 | Very low | 45.7 | Very low | 146 Ų | 146 | 165.2 Ų | 165.2 | 68% | 0.682 | 80% | 0.802 | S | S | * | * | trans | -114.6 | 115.1 | -148.8 | 176.7 | -179.7 | -152.4 | 0 | 0 | 109 | ||||
| 318 | I | 44.7 | Very low | 45.3 | Very low | 166 Ų | 166 | 167.1 Ų | 167.1 | 85% | 0.851 | 80% | 0.804 | S | S | * | * | trans | -140.7 | 118.6 | 163.2 | -58.3 | -178 | 0 | 0 | 0 | 109.6 | ||||
| 319 | H | 43.6 | Very low | 45.9 | Very low | 160 Ų | 160 | 170.7 Ų | 170.7 | 74% | 0.741 | 81% | 0.81 | S | S | * | * | trans | -66.4 | 125 | 171.3 | -74.2 | -98.2 | 0 | 0 | 0 | 111.7 | ||||
| 320 | Q | 45.8 | Very low | 46.9 | Very low | 171 Ų | 171 | 169.4 Ų | 169.4 | 80% | 0.799 | 80% | 0.804 | S | S | * | * | trans | -161.5 | 120.1 | 142.1 | -134.3 | 136.1 | 10.1 | 0 | 0 | 113.3 | ||||
| 321 | T | 46 | Very low | 47.4 | Very low | 123 Ų | 123 | 171.7 Ų | 171.7 | 76% | 0.755 | 80% | 0.802 | S | S | * | * | trans | 44 | 99.3 | 147.2 | 54.8 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 322 | K | 42.2 | Very low | 47.8 | Very low | 222 Ų | 222 | 172 Ų | 172 | 97% | 0.965 | 81% | 0.809 | S | S | * | * | trans | -80.5 | 108.5 | 157.8 | -80.3 | 177 | 176.2 | 172.8 | 0 | 109.2 | ||||
| 323 | E | 52.8 | Low | 48.2 | Very low | 167 Ų | 167 | 175 Ų | 175 | 78% | 0.78 | 83% | 0.831 | S | S | * | * | trans | -127.5 | 115.2 | 165.4 | -154.7 | 166 | -154.7 | 0 | 0 | 108.2 | ||||
| 324 | E | 50 | Low | 48.4 | Very low | 162 Ų | 162 | 175.5 Ų | 175.5 | 76% | 0.757 | 83% | 0.834 | S | S | * | * | trans | 53 | 88.1 | 151 | -58.1 | -172.3 | 161.8 | 0 | 0 | 119.9 | ||||
| 325 | Q | 48 | Very low | 48.5 | Very low | 183 Ų | 183 | 175.2 Ų | 175.2 | 86% | 0.855 | 83% | 0.834 | S | S | * | * | trans | -131.3 | 71.2 | 142.9 | -74 | -165.8 | -4.7 | 0 | 0 | 110.4 | V327 | Q325-V327 PolarHBondContact O-N 2.94Š| ||
| 326 | N | 43.1 | Very low | 48.8 | Very low | 159 Ų | 159 | 176.4 Ų | 176.4 | 85% | 0.85 | 84% | 0.841 | S | S | * | * | trans | -75.7 | 78.3 | 163.3 | -81.9 | -33.3 | 0 | 0 | 0 | 109.5 | ||||
| 327 | V | 53.5 | Low | 49 | Very low | 112 Ų | 112 | 175.1 Ų | 175.1 | 68% | 0.679 | 84% | 0.836 | S | S | * | * | trans | -94.2 | 95.6 | 169.1 | -177 | 0 | 0 | 0 | 0 | 108.7 | Q325 R329 | Q325-V327 PolarHBondContact O-N 2.94Å; V327-R329 PolarHBondContact O-N 3.42Å | ||
| 328 | W | 45.4 | Very low | 49.4 | Very low | 231 Ų | 231 | 176.9 Ų | 176.9 | 88% | 0.875 | 85% | 0.845 | S | S | * | * | trans | 25.1 | 94.2 | 151.7 | -71.2 | 91.2 | 0 | 0 | 0 | 117.6 | ||||
| 329 | R | 60.5 | Low | 49.7 | Very low | 243 Ų | 243 | 177.6 Ų | 177.6 | 92% | 0.917 | 85% | 0.845 | S | S | * | * | trans | -118.9 | 112.7 | 153.3 | -74.5 | -169.8 | -175.3 | -129 | 3.7 | 109.6 | V327 | V327-R329 PolarHBondContact O-N 3.42Š| ||
| 330 | P | 60.3 | Low | 50.1 | Low | 96 Ų | 96 | 178.9 Ų | 178.9 | 62% | 0.623 | 85% | 0.852 | S | S | * | * | trans | -87.4 | 120 | 169.7 | 6.3 | 12.3 | 0 | 0 | 0 | 110.2 | ||||
| 331 | Y | 53.1 | Low | 50.5 | Low | 211 Ų | 211 | 179.5 Ų | 179.5 | 83% | 0.827 | 86% | 0.856 | S | S | * | * | trans | 60.4 | 100 | 153.3 | -59.1 | -81.8 | 0 | 0 | 0 | 119.7 | ||||
| 332 | L | 49.1 | Very low | 50.8 | Low | 178 Ų | 178 | 184.2 Ų | 184.2 | 93% | 0.932 | 87% | 0.865 | S | S | * | * | trans | -150.6 | 91.8 | 143.8 | -80.9 | 177.6 | 0 | 0 | 0 | 108.1 | ||||
| 333 | D | 52.1 | Low | 51.6 | Low | 246 Ų | 246 | 180.7 Ų | 180.7 | 100% | 1.316 | 86% | 0.856 | S | S | * | * | trans | -147.2 | 0 | 147.7 | -94.2 | -22.3 | 0 | 0 | 0 | 107.3 |
Retrieved 333 of 333 residues in 48.6 ms
(Link to these results)